USER MOD reduce.3.24.130724 H: found=0, std=0, add=1133, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1131 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 624 MET CE :methyl -154:sc= -0.788 (180deg=-1.49) USER MOD Set 1.2: A 644 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 550 CYS SG : rot 34:sc=-0.00153 USER MOD Set 2.2: A 612 THR OG1 : rot 98:sc= 1.21 USER MOD Set 2.3: A 613 HIS : no HD1:sc= 1.06 K(o=2.3,f=-2.4!) USER MOD Single : A -1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A -2 HIS : no HD1:sc= -0.0364 X(o=-0.036,f=-0.25) USER MOD Single : A -3 SER OG : rot 180:sc= 0 USER MOD Single : A -4 GLY N :NH3+ 133:sc= 0.0629 (180deg=0) USER MOD Single : A 516 SER OG : rot 180:sc= 0 USER MOD Single : A 520 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 522 LYS NZ :NH3+ -165:sc= 1.2 (180deg=1.16) USER MOD Single : A 528 THR OG1 : rot -144:sc= 0.781 USER MOD Single : A 530 SER OG : rot 180:sc= 0 USER MOD Single : A 532 ASN : amide:sc= -0.0821 X(o=-0.082,f=-0.082) USER MOD Single : A 536 MET CE :methyl 164:sc= -2.99 (180deg=-3.24!) USER MOD Single : A 539 HIS : no HE2:sc= 0.878 K(o=0.88,f=-3.8!) USER MOD Single : A 543 THR OG1 : rot -76:sc= 1.2 USER MOD Single : A 545 LYS NZ :NH3+ -169:sc= 0.753 (180deg=0.502) USER MOD Single : A 547 MET CE :methyl -146:sc= -0.434 (180deg=-0.534) USER MOD Single : A 551 MET CE :methyl 174:sc= -0.0493 (180deg=-0.11) USER MOD Single : A 557 MET CE :methyl 154:sc= -1.07 (180deg=-2.64) USER MOD Single : A 559 THR OG1 : rot 180:sc= 0 USER MOD Single : A 561 GLN : amide:sc= -2.54 X(o=-2.5,f=-2.1) USER MOD Single : A 563 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 564 TYR OH : rot 26:sc= 1.3 USER MOD Single : A 565 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 568 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 570 GLN :FLIP amide:sc= -3.65! C(o=-7.4!,f=-3.6!) USER MOD Single : A 576 TYR OH : rot -35:sc= 1.27 USER MOD Single : A 583 TYR OH : rot 30:sc= -0.0624 USER MOD Single : A 584 THR OG1 : rot 180:sc= 0 USER MOD Single : A 585 SER OG : rot 180:sc= 0.122 USER MOD Single : A 586 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 591 SER OG : rot -160:sc= -0.0128 USER MOD Single : A 594 THR OG1 : rot 180:sc= 0 USER MOD Single : A 595 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 597 ASN :FLIP amide:sc= -0.185 F(o=-1,f=-0.19) USER MOD Single : A 598 SER OG : rot 180:sc= 0 USER MOD Single : A 600 ASN : amide:sc= 0.225 K(o=0.23,f=-0.76) USER MOD Single : A 605 THR OG1 : rot 117:sc= -0.111 USER MOD Single : A 606 MET CE :methyl -142:sc= -0.319 (180deg=-3.01!) USER MOD Single : A 610 TYR OH : rot 180:sc= 0 USER MOD Single : A 616 ASN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 623 CYS SG : rot 140:sc= -0.321 USER MOD Single : A 626 SER OG : rot 180:sc= 0 USER MOD Single : A 628 LYS NZ :NH3+ -169:sc= 0.505 (180deg=0.443) USER MOD Single : A 634 SER OG : rot 180:sc= -0.147 USER MOD Single : A 636 SER OG : rot 180:sc= 0.0143 USER MOD Single : A 637 SER OG : rot 180:sc= 0 USER MOD Single : A 642 THR OG1 : rot 180:sc= 0.00482 USER MOD Single : A 643 THR OG1 : rot 180:sc= 0 USER MOD Single : A 645 ASN : amide:sc= 0.562 K(o=0.56,f=0) USER MOD Single : A 647 TYR OH : rot 180:sc= 0 USER MOD Single : A 649 THR OG1 : rot 79:sc= 1.1 USER MOD Single : A 650 SER OG : rot -33:sc= 0.0224 USER MOD Single : A 651 SER OG : rot 120:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -4 -30.023 -9.182 8.307 1.00 0.00 N ATOM 2 CA GLY A -4 -30.606 -7.903 7.869 1.00 0.00 C ATOM 3 C GLY A -4 -29.546 -7.060 7.178 1.00 0.00 C ATOM 4 O GLY A -4 -28.374 -7.153 7.547 1.00 0.00 O ATOM 0 H1 GLY A -4 -30.302 -9.372 9.291 1.00 0.00 H new ATOM 0 H2 GLY A -4 -30.368 -9.949 7.695 1.00 0.00 H new ATOM 0 H3 GLY A -4 -28.986 -9.130 8.245 1.00 0.00 H new ATOM 0 HA2 GLY A -4 -31.437 -8.087 7.189 1.00 0.00 H new ATOM 0 HA3 GLY A -4 -31.009 -7.365 8.727 1.00 0.00 H new ATOM 8 N SER A -3 -29.931 -6.225 6.207 1.00 0.00 N ATOM 9 CA SER A -3 -29.000 -5.383 5.469 1.00 0.00 C ATOM 10 C SER A -3 -29.622 -4.008 5.213 1.00 0.00 C ATOM 11 O SER A -3 -30.841 -3.903 5.082 1.00 0.00 O ATOM 12 CB SER A -3 -28.622 -6.095 4.161 1.00 0.00 C ATOM 13 OG SER A -3 -27.663 -5.353 3.432 1.00 0.00 O ATOM 0 H SER A -3 -30.902 -6.118 5.914 1.00 0.00 H new ATOM 0 HA SER A -3 -28.092 -5.220 6.050 1.00 0.00 H new ATOM 0 HB2 SER A -3 -28.226 -7.085 4.385 1.00 0.00 H new ATOM 0 HB3 SER A -3 -29.514 -6.239 3.551 1.00 0.00 H new ATOM 0 HG SER A -3 -27.440 -5.830 2.606 1.00 0.00 H new ATOM 19 N HIS A -2 -28.776 -2.978 5.117 1.00 0.00 N ATOM 20 CA HIS A -2 -29.037 -1.654 4.547 1.00 0.00 C ATOM 21 C HIS A -2 -27.655 -1.013 4.388 1.00 0.00 C ATOM 22 O HIS A -2 -26.854 -1.105 5.320 1.00 0.00 O ATOM 23 CB HIS A -2 -29.947 -0.847 5.494 1.00 0.00 C ATOM 24 CG HIS A -2 -30.283 0.577 5.100 1.00 0.00 C ATOM 25 ND1 HIS A -2 -30.552 1.064 3.829 1.00 0.00 N ATOM 26 CD2 HIS A -2 -30.473 1.602 5.987 1.00 0.00 C ATOM 27 CE1 HIS A -2 -30.891 2.365 3.955 1.00 0.00 C ATOM 28 NE2 HIS A -2 -30.842 2.714 5.258 1.00 0.00 N ATOM 0 H HIS A -2 -27.819 -3.054 5.462 1.00 0.00 H new ATOM 0 HA HIS A -2 -29.558 -1.695 3.590 1.00 0.00 H new ATOM 0 HB2 HIS A -2 -30.883 -1.394 5.607 1.00 0.00 H new ATOM 0 HB3 HIS A -2 -29.472 -0.821 6.475 1.00 0.00 H new ATOM 0 HD2 HIS A -2 -30.356 1.550 7.059 1.00 0.00 H new ATOM 0 HE1 HIS A -2 -31.159 3.023 3.141 1.00 0.00 H new ATOM 0 HE2 HIS A -2 -31.043 3.639 5.638 1.00 0.00 H new ATOM 37 N MET A -1 -27.351 -0.371 3.260 1.00 0.00 N ATOM 38 CA MET A -1 -26.048 0.222 2.974 1.00 0.00 C ATOM 39 C MET A -1 -26.292 1.567 2.306 1.00 0.00 C ATOM 40 O MET A -1 -26.523 1.640 1.100 1.00 0.00 O ATOM 41 CB MET A -1 -25.187 -0.707 2.100 1.00 0.00 C ATOM 42 CG MET A -1 -23.772 -0.156 1.872 1.00 0.00 C ATOM 43 SD MET A -1 -22.776 -1.092 0.676 1.00 0.00 S ATOM 44 CE MET A -1 -23.493 -0.506 -0.887 1.00 0.00 C ATOM 0 H MET A -1 -28.022 -0.247 2.502 1.00 0.00 H new ATOM 0 HA MET A -1 -25.486 0.365 3.897 1.00 0.00 H new ATOM 0 HB2 MET A -1 -25.120 -1.687 2.573 1.00 0.00 H new ATOM 0 HB3 MET A -1 -25.677 -0.851 1.137 1.00 0.00 H new ATOM 0 HG2 MET A -1 -23.850 0.876 1.531 1.00 0.00 H new ATOM 0 HG3 MET A -1 -23.246 -0.137 2.826 1.00 0.00 H new ATOM 0 HE1 MET A -1 -22.987 -0.989 -1.723 1.00 0.00 H new ATOM 0 HE2 MET A -1 -24.555 -0.751 -0.915 1.00 0.00 H new ATOM 0 HE3 MET A -1 -23.367 0.574 -0.963 1.00 0.00 H new ATOM 54 N VAL A 513 -26.256 2.618 3.113 1.00 0.00 N ATOM 55 CA VAL A 513 -26.229 4.015 2.696 1.00 0.00 C ATOM 56 C VAL A 513 -25.168 4.709 3.553 1.00 0.00 C ATOM 57 O VAL A 513 -25.034 4.398 4.741 1.00 0.00 O ATOM 58 CB VAL A 513 -27.625 4.660 2.828 1.00 0.00 C ATOM 59 CG1 VAL A 513 -28.597 4.084 1.786 1.00 0.00 C ATOM 60 CG2 VAL A 513 -28.234 4.497 4.231 1.00 0.00 C ATOM 0 H VAL A 513 -26.244 2.515 4.128 1.00 0.00 H new ATOM 0 HA VAL A 513 -25.969 4.113 1.642 1.00 0.00 H new ATOM 0 HB VAL A 513 -27.478 5.726 2.652 1.00 0.00 H new ATOM 0 HG11 VAL A 513 -29.573 4.555 1.900 1.00 0.00 H new ATOM 0 HG12 VAL A 513 -28.214 4.280 0.784 1.00 0.00 H new ATOM 0 HG13 VAL A 513 -28.693 3.008 1.934 1.00 0.00 H new ATOM 0 HG21 VAL A 513 -29.215 4.972 4.259 1.00 0.00 H new ATOM 0 HG22 VAL A 513 -28.337 3.437 4.462 1.00 0.00 H new ATOM 0 HG23 VAL A 513 -27.582 4.967 4.967 1.00 0.00 H new ATOM 70 N LEU A 514 -24.364 5.589 2.967 1.00 0.00 N ATOM 71 CA LEU A 514 -23.243 6.265 3.604 1.00 0.00 C ATOM 72 C LEU A 514 -23.031 7.597 2.877 1.00 0.00 C ATOM 73 O LEU A 514 -23.611 7.771 1.797 1.00 0.00 O ATOM 74 CB LEU A 514 -21.993 5.366 3.566 1.00 0.00 C ATOM 75 CG LEU A 514 -21.349 5.129 2.184 1.00 0.00 C ATOM 76 CD1 LEU A 514 -19.893 4.711 2.392 1.00 0.00 C ATOM 77 CD2 LEU A 514 -22.088 4.039 1.400 1.00 0.00 C ATOM 0 H LEU A 514 -24.482 5.862 1.991 1.00 0.00 H new ATOM 0 HA LEU A 514 -23.445 6.466 4.656 1.00 0.00 H new ATOM 0 HB2 LEU A 514 -21.240 5.803 4.221 1.00 0.00 H new ATOM 0 HB3 LEU A 514 -22.259 4.397 3.988 1.00 0.00 H new ATOM 0 HG LEU A 514 -21.407 6.052 1.607 1.00 0.00 H new ATOM 0 HD11 LEU A 514 -19.422 4.539 1.424 1.00 0.00 H new ATOM 0 HD12 LEU A 514 -19.359 5.501 2.920 1.00 0.00 H new ATOM 0 HD13 LEU A 514 -19.858 3.794 2.980 1.00 0.00 H new ATOM 0 HD21 LEU A 514 -21.608 3.898 0.432 1.00 0.00 H new ATOM 0 HD22 LEU A 514 -22.057 3.104 1.960 1.00 0.00 H new ATOM 0 HD23 LEU A 514 -23.125 4.338 1.250 1.00 0.00 H new ATOM 89 N PRO A 515 -22.231 8.539 3.399 1.00 0.00 N ATOM 90 CA PRO A 515 -21.883 9.727 2.648 1.00 0.00 C ATOM 91 C PRO A 515 -20.799 9.346 1.636 1.00 0.00 C ATOM 92 O PRO A 515 -19.608 9.454 1.927 1.00 0.00 O ATOM 93 CB PRO A 515 -21.438 10.748 3.698 1.00 0.00 C ATOM 94 CG PRO A 515 -20.864 9.899 4.831 1.00 0.00 C ATOM 95 CD PRO A 515 -21.575 8.549 4.705 1.00 0.00 C ATOM 0 HA PRO A 515 -22.696 10.159 2.065 1.00 0.00 H new ATOM 0 HB2 PRO A 515 -20.691 11.432 3.296 1.00 0.00 H new ATOM 0 HB3 PRO A 515 -22.275 11.356 4.041 1.00 0.00 H new ATOM 0 HG2 PRO A 515 -19.784 9.788 4.734 1.00 0.00 H new ATOM 0 HG3 PRO A 515 -21.052 10.356 5.802 1.00 0.00 H new ATOM 0 HD2 PRO A 515 -20.863 7.728 4.787 1.00 0.00 H new ATOM 0 HD3 PRO A 515 -22.304 8.420 5.505 1.00 0.00 H new ATOM 103 N SER A 516 -21.186 8.857 0.455 1.00 0.00 N ATOM 104 CA SER A 516 -20.267 8.877 -0.680 1.00 0.00 C ATOM 105 C SER A 516 -19.917 10.340 -0.986 1.00 0.00 C ATOM 106 O SER A 516 -20.686 11.259 -0.677 1.00 0.00 O ATOM 107 CB SER A 516 -20.870 8.154 -1.893 1.00 0.00 C ATOM 108 OG SER A 516 -21.095 6.788 -1.574 1.00 0.00 O ATOM 0 H SER A 516 -22.103 8.454 0.264 1.00 0.00 H new ATOM 0 HA SER A 516 -19.352 8.337 -0.435 1.00 0.00 H new ATOM 0 HB2 SER A 516 -21.807 8.629 -2.182 1.00 0.00 H new ATOM 0 HB3 SER A 516 -20.197 8.232 -2.747 1.00 0.00 H new ATOM 0 HG SER A 516 -21.481 6.330 -2.350 1.00 0.00 H new ATOM 114 N GLU A 517 -18.762 10.584 -1.600 1.00 0.00 N ATOM 115 CA GLU A 517 -18.201 11.922 -1.782 1.00 0.00 C ATOM 116 C GLU A 517 -17.206 11.870 -2.949 1.00 0.00 C ATOM 117 O GLU A 517 -16.662 10.795 -3.237 1.00 0.00 O ATOM 118 CB GLU A 517 -17.543 12.312 -0.448 1.00 0.00 C ATOM 119 CG GLU A 517 -17.292 13.809 -0.278 1.00 0.00 C ATOM 120 CD GLU A 517 -16.861 14.094 1.162 1.00 0.00 C ATOM 121 OE1 GLU A 517 -17.676 13.889 2.089 1.00 0.00 O ATOM 122 OE2 GLU A 517 -15.665 14.400 1.391 1.00 0.00 O ATOM 0 H GLU A 517 -18.179 9.845 -1.992 1.00 0.00 H new ATOM 0 HA GLU A 517 -18.950 12.674 -2.032 1.00 0.00 H new ATOM 0 HB2 GLU A 517 -18.177 11.968 0.369 1.00 0.00 H new ATOM 0 HB3 GLU A 517 -16.593 11.785 -0.358 1.00 0.00 H new ATOM 0 HG2 GLU A 517 -16.520 14.140 -0.972 1.00 0.00 H new ATOM 0 HG3 GLU A 517 -18.196 14.369 -0.516 1.00 0.00 H new ATOM 129 N ALA A 518 -16.971 12.995 -3.625 1.00 0.00 N ATOM 130 CA ALA A 518 -16.089 13.082 -4.781 1.00 0.00 C ATOM 131 C ALA A 518 -14.776 13.769 -4.378 1.00 0.00 C ATOM 132 O ALA A 518 -14.793 14.973 -4.107 1.00 0.00 O ATOM 133 CB ALA A 518 -16.785 13.845 -5.913 1.00 0.00 C ATOM 0 H ALA A 518 -17.399 13.887 -3.376 1.00 0.00 H new ATOM 0 HA ALA A 518 -15.857 12.079 -5.140 1.00 0.00 H new ATOM 0 HB1 ALA A 518 -16.119 13.906 -6.774 1.00 0.00 H new ATOM 0 HB2 ALA A 518 -17.698 13.322 -6.197 1.00 0.00 H new ATOM 0 HB3 ALA A 518 -17.034 14.851 -5.575 1.00 0.00 H new ATOM 139 N PRO A 519 -13.641 13.052 -4.318 1.00 0.00 N ATOM 140 CA PRO A 519 -12.339 13.693 -4.268 1.00 0.00 C ATOM 141 C PRO A 519 -12.016 14.243 -5.658 1.00 0.00 C ATOM 142 O PRO A 519 -12.392 13.639 -6.669 1.00 0.00 O ATOM 143 CB PRO A 519 -11.375 12.577 -3.880 1.00 0.00 C ATOM 144 CG PRO A 519 -11.987 11.349 -4.557 1.00 0.00 C ATOM 145 CD PRO A 519 -13.489 11.615 -4.490 1.00 0.00 C ATOM 0 HA PRO A 519 -12.285 14.524 -3.565 1.00 0.00 H new ATOM 0 HB2 PRO A 519 -10.364 12.774 -4.237 1.00 0.00 H new ATOM 0 HB3 PRO A 519 -11.313 12.454 -2.799 1.00 0.00 H new ATOM 0 HG2 PRO A 519 -11.643 11.245 -5.586 1.00 0.00 H new ATOM 0 HG3 PRO A 519 -11.719 10.429 -4.037 1.00 0.00 H new ATOM 0 HD2 PRO A 519 -13.985 11.278 -5.400 1.00 0.00 H new ATOM 0 HD3 PRO A 519 -13.943 11.074 -3.660 1.00 0.00 H new ATOM 153 N ASN A 520 -11.265 15.341 -5.726 1.00 0.00 N ATOM 154 CA ASN A 520 -10.897 15.971 -6.993 1.00 0.00 C ATOM 155 C ASN A 520 -9.490 16.570 -6.947 1.00 0.00 C ATOM 156 O ASN A 520 -9.154 17.388 -7.801 1.00 0.00 O ATOM 157 CB ASN A 520 -11.982 16.985 -7.423 1.00 0.00 C ATOM 158 CG ASN A 520 -13.130 16.302 -8.161 1.00 0.00 C ATOM 159 OD1 ASN A 520 -14.231 16.156 -7.640 1.00 0.00 O ATOM 160 ND2 ASN A 520 -12.915 15.876 -9.396 1.00 0.00 N ATOM 0 H ASN A 520 -10.895 15.819 -4.905 1.00 0.00 H new ATOM 0 HA ASN A 520 -10.855 15.202 -7.764 1.00 0.00 H new ATOM 0 HB2 ASN A 520 -12.369 17.499 -6.543 1.00 0.00 H new ATOM 0 HB3 ASN A 520 -11.537 17.744 -8.066 1.00 0.00 H new ATOM 0 HD21 ASN A 520 -13.666 15.425 -9.918 1.00 0.00 H new ATOM 0 HD22 ASN A 520 -11.998 15.999 -9.826 1.00 0.00 H new ATOM 167 N ALA A 521 -8.652 16.194 -5.974 1.00 0.00 N ATOM 168 CA ALA A 521 -7.279 16.672 -5.842 1.00 0.00 C ATOM 169 C ALA A 521 -6.499 16.469 -7.146 1.00 0.00 C ATOM 170 O ALA A 521 -6.282 15.329 -7.571 1.00 0.00 O ATOM 171 CB ALA A 521 -6.568 15.955 -4.687 1.00 0.00 C ATOM 0 H ALA A 521 -8.919 15.535 -5.243 1.00 0.00 H new ATOM 0 HA ALA A 521 -7.316 17.740 -5.625 1.00 0.00 H new ATOM 0 HB1 ALA A 521 -5.546 16.324 -4.604 1.00 0.00 H new ATOM 0 HB2 ALA A 521 -7.101 16.148 -3.756 1.00 0.00 H new ATOM 0 HB3 ALA A 521 -6.552 14.882 -4.880 1.00 0.00 H new ATOM 177 N LYS A 522 -6.052 17.557 -7.783 1.00 0.00 N ATOM 178 CA LYS A 522 -5.140 17.478 -8.929 1.00 0.00 C ATOM 179 C LYS A 522 -3.759 16.984 -8.501 1.00 0.00 C ATOM 180 O LYS A 522 -3.045 16.375 -9.298 1.00 0.00 O ATOM 181 CB LYS A 522 -5.042 18.830 -9.655 1.00 0.00 C ATOM 182 CG LYS A 522 -4.279 19.910 -8.874 1.00 0.00 C ATOM 183 CD LYS A 522 -4.508 21.286 -9.502 1.00 0.00 C ATOM 184 CE LYS A 522 -3.613 22.358 -8.868 1.00 0.00 C ATOM 185 NZ LYS A 522 -3.964 22.673 -7.466 1.00 0.00 N ATOM 0 H LYS A 522 -6.309 18.509 -7.522 1.00 0.00 H new ATOM 0 HA LYS A 522 -5.552 16.752 -9.630 1.00 0.00 H new ATOM 0 HB2 LYS A 522 -4.552 18.679 -10.617 1.00 0.00 H new ATOM 0 HB3 LYS A 522 -6.049 19.191 -9.864 1.00 0.00 H new ATOM 0 HG2 LYS A 522 -4.609 19.918 -7.835 1.00 0.00 H new ATOM 0 HG3 LYS A 522 -3.214 19.679 -8.868 1.00 0.00 H new ATOM 0 HD2 LYS A 522 -4.310 21.234 -10.573 1.00 0.00 H new ATOM 0 HD3 LYS A 522 -5.554 21.570 -9.384 1.00 0.00 H new ATOM 0 HE2 LYS A 522 -2.577 22.023 -8.907 1.00 0.00 H new ATOM 0 HE3 LYS A 522 -3.676 23.269 -9.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 522 -3.503 23.562 -7.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 522 -4.995 22.775 -7.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 522 -3.640 21.903 -6.846 1.00 0.00 H new ATOM 199 N GLU A 523 -3.390 17.272 -7.255 1.00 0.00 N ATOM 200 CA GLU A 523 -2.058 17.071 -6.716 1.00 0.00 C ATOM 201 C GLU A 523 -1.797 15.605 -6.377 1.00 0.00 C ATOM 202 O GLU A 523 -2.671 14.734 -6.467 1.00 0.00 O ATOM 203 CB GLU A 523 -1.910 17.975 -5.481 1.00 0.00 C ATOM 204 CG GLU A 523 -1.623 19.420 -5.911 1.00 0.00 C ATOM 205 CD GLU A 523 -2.329 20.410 -5.001 1.00 0.00 C ATOM 206 OE1 GLU A 523 -1.805 20.715 -3.910 1.00 0.00 O ATOM 207 OE2 GLU A 523 -3.414 20.900 -5.404 1.00 0.00 O ATOM 0 H GLU A 523 -4.038 17.666 -6.573 1.00 0.00 H new ATOM 0 HA GLU A 523 -1.312 17.338 -7.465 1.00 0.00 H new ATOM 0 HB2 GLU A 523 -2.822 17.940 -4.885 1.00 0.00 H new ATOM 0 HB3 GLU A 523 -1.101 17.609 -4.849 1.00 0.00 H new ATOM 0 HG2 GLU A 523 -0.549 19.603 -5.889 1.00 0.00 H new ATOM 0 HG3 GLU A 523 -1.951 19.569 -6.940 1.00 0.00 H new ATOM 214 N GLU A 524 -0.553 15.339 -5.992 1.00 0.00 N ATOM 215 CA GLU A 524 -0.062 14.052 -5.552 1.00 0.00 C ATOM 216 C GLU A 524 1.216 14.214 -4.738 1.00 0.00 C ATOM 217 O GLU A 524 1.983 15.165 -4.909 1.00 0.00 O ATOM 218 CB GLU A 524 0.213 13.146 -6.750 1.00 0.00 C ATOM 219 CG GLU A 524 1.104 13.794 -7.829 1.00 0.00 C ATOM 220 CD GLU A 524 1.416 12.849 -8.983 1.00 0.00 C ATOM 221 OE1 GLU A 524 0.796 11.771 -9.091 1.00 0.00 O ATOM 222 OE2 GLU A 524 2.307 13.167 -9.800 1.00 0.00 O ATOM 0 H GLU A 524 0.172 16.057 -5.980 1.00 0.00 H new ATOM 0 HA GLU A 524 -0.829 13.597 -4.926 1.00 0.00 H new ATOM 0 HB2 GLU A 524 0.690 12.231 -6.400 1.00 0.00 H new ATOM 0 HB3 GLU A 524 -0.736 12.858 -7.201 1.00 0.00 H new ATOM 0 HG2 GLU A 524 0.608 14.683 -8.218 1.00 0.00 H new ATOM 0 HG3 GLU A 524 2.037 14.124 -7.373 1.00 0.00 H new ATOM 229 N ILE A 525 1.439 13.259 -3.845 1.00 0.00 N ATOM 230 CA ILE A 525 2.514 13.287 -2.871 1.00 0.00 C ATOM 231 C ILE A 525 3.596 12.342 -3.376 1.00 0.00 C ATOM 232 O ILE A 525 3.281 11.374 -4.074 1.00 0.00 O ATOM 233 CB ILE A 525 1.944 12.907 -1.492 1.00 0.00 C ATOM 234 CG1 ILE A 525 0.688 13.747 -1.160 1.00 0.00 C ATOM 235 CG2 ILE A 525 2.990 13.060 -0.376 1.00 0.00 C ATOM 236 CD1 ILE A 525 0.790 15.251 -1.438 1.00 0.00 C ATOM 0 H ILE A 525 0.860 12.422 -3.779 1.00 0.00 H new ATOM 0 HA ILE A 525 2.960 14.274 -2.751 1.00 0.00 H new ATOM 0 HB ILE A 525 1.662 11.856 -1.545 1.00 0.00 H new ATOM 0 HG12 ILE A 525 -0.152 13.349 -1.730 1.00 0.00 H new ATOM 0 HG13 ILE A 525 0.451 13.608 -0.105 1.00 0.00 H new ATOM 0 HG21 ILE A 525 2.546 12.782 0.580 1.00 0.00 H new ATOM 0 HG22 ILE A 525 3.841 12.411 -0.583 1.00 0.00 H new ATOM 0 HG23 ILE A 525 3.326 14.096 -0.332 1.00 0.00 H new ATOM 0 HD11 ILE A 525 -0.148 15.735 -1.167 1.00 0.00 H new ATOM 0 HD12 ILE A 525 1.602 15.676 -0.847 1.00 0.00 H new ATOM 0 HD13 ILE A 525 0.989 15.412 -2.497 1.00 0.00 H new ATOM 248 N LEU A 526 4.845 12.588 -3.005 1.00 0.00 N ATOM 249 CA LEU A 526 6.001 11.782 -3.360 1.00 0.00 C ATOM 250 C LEU A 526 6.865 11.643 -2.116 1.00 0.00 C ATOM 251 O LEU A 526 6.635 12.278 -1.080 1.00 0.00 O ATOM 252 CB LEU A 526 6.769 12.460 -4.516 1.00 0.00 C ATOM 253 CG LEU A 526 6.793 11.783 -5.902 1.00 0.00 C ATOM 254 CD1 LEU A 526 7.911 10.744 -5.954 1.00 0.00 C ATOM 255 CD2 LEU A 526 5.460 11.163 -6.347 1.00 0.00 C ATOM 0 H LEU A 526 5.089 13.390 -2.423 1.00 0.00 H new ATOM 0 HA LEU A 526 5.705 10.791 -3.705 1.00 0.00 H new ATOM 0 HB2 LEU A 526 6.352 13.459 -4.646 1.00 0.00 H new ATOM 0 HB3 LEU A 526 7.803 12.586 -4.194 1.00 0.00 H new ATOM 0 HG LEU A 526 6.981 12.585 -6.616 1.00 0.00 H new ATOM 0 HD11 LEU A 526 7.922 10.270 -6.936 1.00 0.00 H new ATOM 0 HD12 LEU A 526 8.869 11.232 -5.776 1.00 0.00 H new ATOM 0 HD13 LEU A 526 7.741 9.988 -5.188 1.00 0.00 H new ATOM 0 HD21 LEU A 526 5.579 10.712 -7.332 1.00 0.00 H new ATOM 0 HD22 LEU A 526 5.158 10.398 -5.632 1.00 0.00 H new ATOM 0 HD23 LEU A 526 4.695 11.938 -6.393 1.00 0.00 H new ATOM 267 N GLY A 527 7.892 10.817 -2.255 1.00 0.00 N ATOM 268 CA GLY A 527 8.787 10.473 -1.168 1.00 0.00 C ATOM 269 C GLY A 527 8.106 9.668 -0.062 1.00 0.00 C ATOM 270 O GLY A 527 6.948 9.255 -0.156 1.00 0.00 O ATOM 0 H GLY A 527 8.127 10.363 -3.138 1.00 0.00 H new ATOM 0 HA2 GLY A 527 9.625 9.899 -1.563 1.00 0.00 H new ATOM 0 HA3 GLY A 527 9.200 11.387 -0.742 1.00 0.00 H new ATOM 274 N THR A 528 8.860 9.410 1.000 1.00 0.00 N ATOM 275 CA THR A 528 8.365 8.774 2.207 1.00 0.00 C ATOM 276 C THR A 528 7.702 9.839 3.098 1.00 0.00 C ATOM 277 O THR A 528 8.085 11.015 3.068 1.00 0.00 O ATOM 278 CB THR A 528 9.559 8.079 2.877 1.00 0.00 C ATOM 279 OG1 THR A 528 10.224 7.277 1.918 1.00 0.00 O ATOM 280 CG2 THR A 528 9.205 7.193 4.077 1.00 0.00 C ATOM 0 H THR A 528 9.852 9.643 1.043 1.00 0.00 H new ATOM 0 HA THR A 528 7.602 8.022 2.003 1.00 0.00 H new ATOM 0 HB THR A 528 10.186 8.883 3.262 1.00 0.00 H new ATOM 0 HG1 THR A 528 10.550 6.458 2.346 1.00 0.00 H new ATOM 0 HG21 THR A 528 10.114 6.747 4.481 1.00 0.00 H new ATOM 0 HG22 THR A 528 8.725 7.797 4.846 1.00 0.00 H new ATOM 0 HG23 THR A 528 8.524 6.404 3.758 1.00 0.00 H new ATOM 288 N VAL A 529 6.732 9.417 3.903 1.00 0.00 N ATOM 289 CA VAL A 529 5.935 10.203 4.840 1.00 0.00 C ATOM 290 C VAL A 529 5.707 9.368 6.114 1.00 0.00 C ATOM 291 O VAL A 529 6.064 8.188 6.166 1.00 0.00 O ATOM 292 CB VAL A 529 4.608 10.644 4.171 1.00 0.00 C ATOM 293 CG1 VAL A 529 4.844 11.677 3.057 1.00 0.00 C ATOM 294 CG2 VAL A 529 3.811 9.466 3.586 1.00 0.00 C ATOM 0 H VAL A 529 6.460 8.434 3.918 1.00 0.00 H new ATOM 0 HA VAL A 529 6.460 11.116 5.122 1.00 0.00 H new ATOM 0 HB VAL A 529 4.023 11.095 4.973 1.00 0.00 H new ATOM 0 HG11 VAL A 529 3.889 11.959 2.614 1.00 0.00 H new ATOM 0 HG12 VAL A 529 5.325 12.561 3.476 1.00 0.00 H new ATOM 0 HG13 VAL A 529 5.486 11.244 2.290 1.00 0.00 H new ATOM 0 HG21 VAL A 529 2.893 9.838 3.132 1.00 0.00 H new ATOM 0 HG22 VAL A 529 4.411 8.960 2.830 1.00 0.00 H new ATOM 0 HG23 VAL A 529 3.563 8.763 4.382 1.00 0.00 H new ATOM 304 N SER A 530 5.105 9.963 7.144 1.00 0.00 N ATOM 305 CA SER A 530 4.873 9.349 8.451 1.00 0.00 C ATOM 306 C SER A 530 3.364 9.320 8.701 1.00 0.00 C ATOM 307 O SER A 530 2.815 9.888 9.652 1.00 0.00 O ATOM 308 CB SER A 530 5.752 10.049 9.495 1.00 0.00 C ATOM 309 OG SER A 530 5.776 11.463 9.346 1.00 0.00 O ATOM 0 H SER A 530 4.753 10.919 7.089 1.00 0.00 H new ATOM 0 HA SER A 530 5.183 8.306 8.511 1.00 0.00 H new ATOM 0 HB2 SER A 530 5.389 9.801 10.492 1.00 0.00 H new ATOM 0 HB3 SER A 530 6.769 9.665 9.421 1.00 0.00 H new ATOM 0 HG SER A 530 6.349 11.855 10.038 1.00 0.00 H new ATOM 315 N TRP A 531 2.686 8.693 7.744 1.00 0.00 N ATOM 316 CA TRP A 531 1.277 8.358 7.753 1.00 0.00 C ATOM 317 C TRP A 531 1.157 7.008 8.470 1.00 0.00 C ATOM 318 O TRP A 531 2.092 6.577 9.146 1.00 0.00 O ATOM 319 CB TRP A 531 0.767 8.357 6.297 1.00 0.00 C ATOM 320 CG TRP A 531 0.756 9.676 5.571 1.00 0.00 C ATOM 321 CD1 TRP A 531 1.134 10.871 6.079 1.00 0.00 C ATOM 322 CD2 TRP A 531 0.419 9.945 4.173 1.00 0.00 C ATOM 323 NE1 TRP A 531 1.111 11.836 5.093 1.00 0.00 N ATOM 324 CE2 TRP A 531 0.692 11.316 3.891 1.00 0.00 C ATOM 325 CE3 TRP A 531 -0.053 9.164 3.096 1.00 0.00 C ATOM 326 CZ2 TRP A 531 0.546 11.868 2.609 1.00 0.00 C ATOM 327 CZ3 TRP A 531 -0.192 9.700 1.802 1.00 0.00 C ATOM 328 CH2 TRP A 531 0.117 11.047 1.554 1.00 0.00 C ATOM 0 H TRP A 531 3.144 8.387 6.885 1.00 0.00 H new ATOM 0 HA TRP A 531 0.654 9.076 8.286 1.00 0.00 H new ATOM 0 HB2 TRP A 531 1.381 7.661 5.725 1.00 0.00 H new ATOM 0 HB3 TRP A 531 -0.249 7.962 6.295 1.00 0.00 H new ATOM 0 HD1 TRP A 531 1.413 11.045 7.108 1.00 0.00 H new ATOM 0 HE1 TRP A 531 1.372 12.811 5.237 1.00 0.00 H new ATOM 0 HE3 TRP A 531 -0.314 8.130 3.269 1.00 0.00 H new ATOM 0 HZ2 TRP A 531 0.761 12.912 2.436 1.00 0.00 H new ATOM 0 HZ3 TRP A 531 -0.538 9.071 0.995 1.00 0.00 H new ATOM 0 HH2 TRP A 531 0.025 11.450 0.556 1.00 0.00 H new ATOM 339 N ASN A 532 -0.006 6.353 8.402 1.00 0.00 N ATOM 340 CA ASN A 532 -0.193 5.050 9.039 1.00 0.00 C ATOM 341 C ASN A 532 -0.987 4.158 8.108 1.00 0.00 C ATOM 342 O ASN A 532 -0.408 3.544 7.220 1.00 0.00 O ATOM 343 CB ASN A 532 -0.814 5.194 10.438 1.00 0.00 C ATOM 344 CG ASN A 532 0.245 5.694 11.399 1.00 0.00 C ATOM 345 OD1 ASN A 532 1.028 4.904 11.913 1.00 0.00 O ATOM 346 ND2 ASN A 532 0.301 7.002 11.595 1.00 0.00 N ATOM 0 H ASN A 532 -0.829 6.704 7.913 1.00 0.00 H new ATOM 0 HA ASN A 532 0.772 4.573 9.208 1.00 0.00 H new ATOM 0 HB2 ASN A 532 -1.653 5.889 10.408 1.00 0.00 H new ATOM 0 HB3 ASN A 532 -1.207 4.235 10.776 1.00 0.00 H new ATOM 0 HD21 ASN A 532 1.022 7.397 12.199 1.00 0.00 H new ATOM 0 HD22 ASN A 532 -0.377 7.615 11.142 1.00 0.00 H new ATOM 353 N LEU A 533 -2.315 4.116 8.233 1.00 0.00 N ATOM 354 CA LEU A 533 -3.185 3.270 7.419 1.00 0.00 C ATOM 355 C LEU A 533 -4.392 4.069 6.943 1.00 0.00 C ATOM 356 O LEU A 533 -4.664 4.098 5.749 1.00 0.00 O ATOM 357 CB LEU A 533 -3.605 2.033 8.237 1.00 0.00 C ATOM 358 CG LEU A 533 -4.573 1.079 7.514 1.00 0.00 C ATOM 359 CD1 LEU A 533 -3.968 0.491 6.238 1.00 0.00 C ATOM 360 CD2 LEU A 533 -4.938 -0.069 8.463 1.00 0.00 C ATOM 0 H LEU A 533 -2.823 4.679 8.915 1.00 0.00 H new ATOM 0 HA LEU A 533 -2.649 2.927 6.534 1.00 0.00 H new ATOM 0 HB2 LEU A 533 -2.709 1.477 8.515 1.00 0.00 H new ATOM 0 HB3 LEU A 533 -4.072 2.369 9.163 1.00 0.00 H new ATOM 0 HG LEU A 533 -5.454 1.654 7.229 1.00 0.00 H new ATOM 0 HD11 LEU A 533 -4.691 -0.175 5.766 1.00 0.00 H new ATOM 0 HD12 LEU A 533 -3.715 1.298 5.550 1.00 0.00 H new ATOM 0 HD13 LEU A 533 -3.067 -0.070 6.487 1.00 0.00 H new ATOM 0 HD21 LEU A 533 -5.624 -0.752 7.961 1.00 0.00 H new ATOM 0 HD22 LEU A 533 -4.034 -0.607 8.748 1.00 0.00 H new ATOM 0 HD23 LEU A 533 -5.416 0.335 9.355 1.00 0.00 H new ATOM 372 N ARG A 534 -5.125 4.749 7.830 1.00 0.00 N ATOM 373 CA ARG A 534 -6.309 5.489 7.385 1.00 0.00 C ATOM 374 C ARG A 534 -5.921 6.655 6.482 1.00 0.00 C ATOM 375 O ARG A 534 -6.570 6.840 5.458 1.00 0.00 O ATOM 376 CB ARG A 534 -7.132 6.014 8.562 1.00 0.00 C ATOM 377 CG ARG A 534 -7.625 4.916 9.516 1.00 0.00 C ATOM 378 CD ARG A 534 -8.798 5.498 10.301 1.00 0.00 C ATOM 379 NE ARG A 534 -9.076 4.800 11.559 1.00 0.00 N ATOM 380 CZ ARG A 534 -10.044 5.148 12.412 1.00 0.00 C ATOM 381 NH1 ARG A 534 -10.942 6.070 12.070 1.00 0.00 N ATOM 382 NH2 ARG A 534 -10.096 4.575 13.608 1.00 0.00 N ATOM 0 H ARG A 534 -4.929 4.803 8.829 1.00 0.00 H new ATOM 0 HA ARG A 534 -6.922 4.784 6.823 1.00 0.00 H new ATOM 0 HB2 ARG A 534 -6.529 6.727 9.125 1.00 0.00 H new ATOM 0 HB3 ARG A 534 -7.993 6.560 8.176 1.00 0.00 H new ATOM 0 HG2 ARG A 534 -7.935 4.032 8.959 1.00 0.00 H new ATOM 0 HG3 ARG A 534 -6.827 4.604 10.190 1.00 0.00 H new ATOM 0 HD2 ARG A 534 -8.593 6.547 10.516 1.00 0.00 H new ATOM 0 HD3 ARG A 534 -9.691 5.469 9.676 1.00 0.00 H new ATOM 0 HE ARG A 534 -8.494 3.998 11.799 1.00 0.00 H new ATOM 0 HH11 ARG A 534 -10.893 6.514 11.153 1.00 0.00 H new ATOM 0 HH12 ARG A 534 -11.679 6.332 12.725 1.00 0.00 H new ATOM 0 HH21 ARG A 534 -9.401 3.876 13.869 1.00 0.00 H new ATOM 0 HH22 ARG A 534 -10.831 4.834 14.266 1.00 0.00 H new ATOM 396 N GLU A 535 -4.842 7.374 6.817 1.00 0.00 N ATOM 397 CA GLU A 535 -4.302 8.455 5.986 1.00 0.00 C ATOM 398 C GLU A 535 -4.062 7.963 4.557 1.00 0.00 C ATOM 399 O GLU A 535 -4.356 8.628 3.564 1.00 0.00 O ATOM 400 CB GLU A 535 -2.954 8.905 6.561 1.00 0.00 C ATOM 401 CG GLU A 535 -3.045 9.486 7.970 1.00 0.00 C ATOM 402 CD GLU A 535 -2.185 10.731 8.135 1.00 0.00 C ATOM 403 OE1 GLU A 535 -2.650 11.811 7.701 1.00 0.00 O ATOM 404 OE2 GLU A 535 -1.105 10.622 8.757 1.00 0.00 O ATOM 0 H GLU A 535 -4.317 7.220 7.678 1.00 0.00 H new ATOM 0 HA GLU A 535 -5.019 9.276 5.978 1.00 0.00 H new ATOM 0 HB2 GLU A 535 -2.273 8.054 6.573 1.00 0.00 H new ATOM 0 HB3 GLU A 535 -2.519 9.652 5.898 1.00 0.00 H new ATOM 0 HG2 GLU A 535 -4.083 9.731 8.194 1.00 0.00 H new ATOM 0 HG3 GLU A 535 -2.733 8.732 8.693 1.00 0.00 H new ATOM 411 N MET A 536 -3.501 6.760 4.478 1.00 0.00 N ATOM 412 CA MET A 536 -3.088 6.123 3.254 1.00 0.00 C ATOM 413 C MET A 536 -4.309 5.760 2.432 1.00 0.00 C ATOM 414 O MET A 536 -4.333 6.040 1.238 1.00 0.00 O ATOM 415 CB MET A 536 -2.300 4.866 3.606 1.00 0.00 C ATOM 416 CG MET A 536 -1.042 5.177 4.412 1.00 0.00 C ATOM 417 SD MET A 536 0.323 5.601 3.341 1.00 0.00 S ATOM 418 CE MET A 536 0.680 3.926 2.802 1.00 0.00 C ATOM 0 H MET A 536 -3.319 6.189 5.303 1.00 0.00 H new ATOM 0 HA MET A 536 -2.463 6.798 2.669 1.00 0.00 H new ATOM 0 HB2 MET A 536 -2.936 4.189 4.176 1.00 0.00 H new ATOM 0 HB3 MET A 536 -2.022 4.346 2.689 1.00 0.00 H new ATOM 0 HG2 MET A 536 -1.240 6.002 5.097 1.00 0.00 H new ATOM 0 HG3 MET A 536 -0.775 4.314 5.022 1.00 0.00 H new ATOM 0 HE1 MET A 536 1.310 3.956 1.913 1.00 0.00 H new ATOM 0 HE2 MET A 536 1.199 3.391 3.597 1.00 0.00 H new ATOM 0 HE3 MET A 536 -0.253 3.413 2.568 1.00 0.00 H new ATOM 428 N LEU A 537 -5.309 5.143 3.070 1.00 0.00 N ATOM 429 CA LEU A 537 -6.565 4.768 2.440 1.00 0.00 C ATOM 430 C LEU A 537 -7.269 5.993 1.874 1.00 0.00 C ATOM 431 O LEU A 537 -7.829 5.888 0.786 1.00 0.00 O ATOM 432 CB LEU A 537 -7.475 4.020 3.436 1.00 0.00 C ATOM 433 CG LEU A 537 -6.959 2.615 3.805 1.00 0.00 C ATOM 434 CD1 LEU A 537 -7.846 1.939 4.856 1.00 0.00 C ATOM 435 CD2 LEU A 537 -6.921 1.708 2.582 1.00 0.00 C ATOM 0 H LEU A 537 -5.261 4.889 4.057 1.00 0.00 H new ATOM 0 HA LEU A 537 -6.344 4.093 1.613 1.00 0.00 H new ATOM 0 HB2 LEU A 537 -7.570 4.614 4.345 1.00 0.00 H new ATOM 0 HB3 LEU A 537 -8.473 3.931 3.007 1.00 0.00 H new ATOM 0 HG LEU A 537 -5.956 2.756 4.207 1.00 0.00 H new ATOM 0 HD11 LEU A 537 -7.447 0.951 5.088 1.00 0.00 H new ATOM 0 HD12 LEU A 537 -7.863 2.545 5.762 1.00 0.00 H new ATOM 0 HD13 LEU A 537 -8.859 1.839 4.467 1.00 0.00 H new ATOM 0 HD21 LEU A 537 -6.553 0.723 2.871 1.00 0.00 H new ATOM 0 HD22 LEU A 537 -7.925 1.613 2.168 1.00 0.00 H new ATOM 0 HD23 LEU A 537 -6.258 2.137 1.831 1.00 0.00 H new ATOM 447 N ALA A 538 -7.227 7.130 2.576 1.00 0.00 N ATOM 448 CA ALA A 538 -7.780 8.378 2.077 1.00 0.00 C ATOM 449 C ALA A 538 -7.055 8.796 0.795 1.00 0.00 C ATOM 450 O ALA A 538 -7.690 8.882 -0.250 1.00 0.00 O ATOM 451 CB ALA A 538 -7.714 9.457 3.166 1.00 0.00 C ATOM 0 H ALA A 538 -6.808 7.204 3.503 1.00 0.00 H new ATOM 0 HA ALA A 538 -8.831 8.240 1.824 1.00 0.00 H new ATOM 0 HB1 ALA A 538 -8.131 10.388 2.782 1.00 0.00 H new ATOM 0 HB2 ALA A 538 -8.288 9.133 4.034 1.00 0.00 H new ATOM 0 HB3 ALA A 538 -6.676 9.617 3.457 1.00 0.00 H new ATOM 457 N HIS A 539 -5.734 9.006 0.838 1.00 0.00 N ATOM 458 CA HIS A 539 -4.975 9.469 -0.328 1.00 0.00 C ATOM 459 C HIS A 539 -5.092 8.512 -1.520 1.00 0.00 C ATOM 460 O HIS A 539 -5.244 8.952 -2.662 1.00 0.00 O ATOM 461 CB HIS A 539 -3.510 9.682 0.055 1.00 0.00 C ATOM 462 CG HIS A 539 -2.703 10.234 -1.090 1.00 0.00 C ATOM 463 ND1 HIS A 539 -2.952 11.423 -1.749 1.00 0.00 N ATOM 464 CD2 HIS A 539 -1.665 9.604 -1.717 1.00 0.00 C ATOM 465 CE1 HIS A 539 -2.062 11.526 -2.748 1.00 0.00 C ATOM 466 NE2 HIS A 539 -1.259 10.439 -2.744 1.00 0.00 N ATOM 0 H HIS A 539 -5.167 8.861 1.673 1.00 0.00 H new ATOM 0 HA HIS A 539 -5.407 10.418 -0.646 1.00 0.00 H new ATOM 0 HB2 HIS A 539 -3.452 10.366 0.902 1.00 0.00 H new ATOM 0 HB3 HIS A 539 -3.079 8.735 0.379 1.00 0.00 H new ATOM 0 HD1 HIS A 539 -3.680 12.099 -1.518 1.00 0.00 H new ATOM 0 HD2 HIS A 539 -1.244 8.643 -1.461 1.00 0.00 H new ATOM 0 HE1 HIS A 539 -1.998 12.348 -3.445 1.00 0.00 H new ATOM 475 N ALA A 540 -4.984 7.210 -1.263 1.00 0.00 N ATOM 476 CA ALA A 540 -5.250 6.136 -2.207 1.00 0.00 C ATOM 477 C ALA A 540 -6.600 6.333 -2.892 1.00 0.00 C ATOM 478 O ALA A 540 -6.629 6.418 -4.117 1.00 0.00 O ATOM 479 CB ALA A 540 -5.229 4.801 -1.459 1.00 0.00 C ATOM 0 H ALA A 540 -4.695 6.863 -0.348 1.00 0.00 H new ATOM 0 HA ALA A 540 -4.480 6.141 -2.979 1.00 0.00 H new ATOM 0 HB1 ALA A 540 -5.428 3.989 -2.158 1.00 0.00 H new ATOM 0 HB2 ALA A 540 -4.250 4.655 -1.002 1.00 0.00 H new ATOM 0 HB3 ALA A 540 -5.994 4.807 -0.683 1.00 0.00 H new ATOM 485 N GLU A 541 -7.699 6.409 -2.129 1.00 0.00 N ATOM 486 CA GLU A 541 -9.032 6.621 -2.673 1.00 0.00 C ATOM 487 C GLU A 541 -9.047 7.891 -3.504 1.00 0.00 C ATOM 488 O GLU A 541 -9.444 7.840 -4.661 1.00 0.00 O ATOM 489 CB GLU A 541 -10.097 6.739 -1.568 1.00 0.00 C ATOM 490 CG GLU A 541 -10.994 5.507 -1.470 1.00 0.00 C ATOM 491 CD GLU A 541 -12.295 5.766 -0.710 1.00 0.00 C ATOM 492 OE1 GLU A 541 -13.022 6.752 -0.989 1.00 0.00 O ATOM 493 OE2 GLU A 541 -12.607 4.992 0.222 1.00 0.00 O ATOM 0 H GLU A 541 -7.680 6.324 -1.113 1.00 0.00 H new ATOM 0 HA GLU A 541 -9.274 5.754 -3.288 1.00 0.00 H new ATOM 0 HB2 GLU A 541 -9.602 6.899 -0.610 1.00 0.00 H new ATOM 0 HB3 GLU A 541 -10.714 7.617 -1.758 1.00 0.00 H new ATOM 0 HG2 GLU A 541 -11.232 5.158 -2.475 1.00 0.00 H new ATOM 0 HG3 GLU A 541 -10.446 4.705 -0.975 1.00 0.00 H new ATOM 500 N GLU A 542 -8.618 9.003 -2.911 1.00 0.00 N ATOM 501 CA GLU A 542 -8.623 10.346 -3.465 1.00 0.00 C ATOM 502 C GLU A 542 -8.074 10.337 -4.885 1.00 0.00 C ATOM 503 O GLU A 542 -8.736 10.769 -5.830 1.00 0.00 O ATOM 504 CB GLU A 542 -7.813 11.246 -2.521 1.00 0.00 C ATOM 505 CG GLU A 542 -7.381 12.611 -3.069 1.00 0.00 C ATOM 506 CD GLU A 542 -6.418 13.247 -2.071 1.00 0.00 C ATOM 507 OE1 GLU A 542 -5.258 12.786 -1.957 1.00 0.00 O ATOM 508 OE2 GLU A 542 -6.845 14.142 -1.316 1.00 0.00 O ATOM 0 H GLU A 542 -8.232 8.983 -1.967 1.00 0.00 H new ATOM 0 HA GLU A 542 -9.638 10.738 -3.537 1.00 0.00 H new ATOM 0 HB2 GLU A 542 -8.404 11.413 -1.621 1.00 0.00 H new ATOM 0 HB3 GLU A 542 -6.918 10.703 -2.218 1.00 0.00 H new ATOM 0 HG2 GLU A 542 -6.899 12.495 -4.040 1.00 0.00 H new ATOM 0 HG3 GLU A 542 -8.250 13.252 -3.219 1.00 0.00 H new ATOM 515 N THR A 543 -6.865 9.811 -5.032 1.00 0.00 N ATOM 516 CA THR A 543 -6.126 9.865 -6.280 1.00 0.00 C ATOM 517 C THR A 543 -6.364 8.636 -7.170 1.00 0.00 C ATOM 518 O THR A 543 -5.873 8.593 -8.301 1.00 0.00 O ATOM 519 CB THR A 543 -4.643 10.112 -5.974 1.00 0.00 C ATOM 520 OG1 THR A 543 -4.102 9.164 -5.071 1.00 0.00 O ATOM 521 CG2 THR A 543 -4.397 11.492 -5.361 1.00 0.00 C ATOM 0 H THR A 543 -6.369 9.332 -4.281 1.00 0.00 H new ATOM 0 HA THR A 543 -6.499 10.700 -6.873 1.00 0.00 H new ATOM 0 HB THR A 543 -4.153 10.029 -6.944 1.00 0.00 H new ATOM 0 HG1 THR A 543 -4.410 9.364 -4.163 1.00 0.00 H new ATOM 0 HG21 THR A 543 -3.333 11.618 -5.163 1.00 0.00 H new ATOM 0 HG22 THR A 543 -4.730 12.263 -6.055 1.00 0.00 H new ATOM 0 HG23 THR A 543 -4.953 11.580 -4.427 1.00 0.00 H new ATOM 529 N ARG A 544 -7.136 7.649 -6.693 1.00 0.00 N ATOM 530 CA ARG A 544 -7.280 6.304 -7.266 1.00 0.00 C ATOM 531 C ARG A 544 -5.909 5.631 -7.486 1.00 0.00 C ATOM 532 O ARG A 544 -5.740 4.833 -8.415 1.00 0.00 O ATOM 533 CB ARG A 544 -8.209 6.288 -8.503 1.00 0.00 C ATOM 534 CG ARG A 544 -9.700 6.550 -8.201 1.00 0.00 C ATOM 535 CD ARG A 544 -10.010 8.011 -7.861 1.00 0.00 C ATOM 536 NE ARG A 544 -11.450 8.334 -7.946 1.00 0.00 N ATOM 537 CZ ARG A 544 -12.323 8.419 -6.929 1.00 0.00 C ATOM 538 NH1 ARG A 544 -11.979 8.116 -5.684 1.00 0.00 N ATOM 539 NH2 ARG A 544 -13.570 8.813 -7.146 1.00 0.00 N ATOM 0 H ARG A 544 -7.705 7.774 -5.856 1.00 0.00 H new ATOM 0 HA ARG A 544 -7.793 5.681 -6.533 1.00 0.00 H new ATOM 0 HB2 ARG A 544 -7.860 7.039 -9.211 1.00 0.00 H new ATOM 0 HB3 ARG A 544 -8.118 5.320 -8.995 1.00 0.00 H new ATOM 0 HG2 ARG A 544 -10.295 6.253 -9.065 1.00 0.00 H new ATOM 0 HG3 ARG A 544 -10.010 5.918 -7.368 1.00 0.00 H new ATOM 0 HD2 ARG A 544 -9.654 8.226 -6.853 1.00 0.00 H new ATOM 0 HD3 ARG A 544 -9.457 8.661 -8.540 1.00 0.00 H new ATOM 0 HE ARG A 544 -11.821 8.512 -8.879 1.00 0.00 H new ATOM 0 HH11 ARG A 544 -11.029 7.808 -5.478 1.00 0.00 H new ATOM 0 HH12 ARG A 544 -12.665 8.191 -4.933 1.00 0.00 H new ATOM 0 HH21 ARG A 544 -13.872 9.054 -8.090 1.00 0.00 H new ATOM 0 HH22 ARG A 544 -14.228 8.875 -6.369 1.00 0.00 H new ATOM 553 N LYS A 545 -4.902 5.973 -6.668 1.00 0.00 N ATOM 554 CA LYS A 545 -3.570 5.362 -6.726 1.00 0.00 C ATOM 555 C LYS A 545 -3.639 3.907 -6.277 1.00 0.00 C ATOM 556 O LYS A 545 -4.612 3.491 -5.640 1.00 0.00 O ATOM 557 CB LYS A 545 -2.536 6.198 -5.952 1.00 0.00 C ATOM 558 CG LYS A 545 -2.132 7.402 -6.821 1.00 0.00 C ATOM 559 CD LYS A 545 -1.215 8.396 -6.101 1.00 0.00 C ATOM 560 CE LYS A 545 -1.196 9.763 -6.810 1.00 0.00 C ATOM 561 NZ LYS A 545 -0.654 9.702 -8.180 1.00 0.00 N ATOM 0 H LYS A 545 -4.992 6.686 -5.944 1.00 0.00 H new ATOM 0 HA LYS A 545 -3.223 5.355 -7.759 1.00 0.00 H new ATOM 0 HB2 LYS A 545 -2.956 6.538 -5.005 1.00 0.00 H new ATOM 0 HB3 LYS A 545 -1.662 5.593 -5.714 1.00 0.00 H new ATOM 0 HG2 LYS A 545 -1.629 7.040 -7.718 1.00 0.00 H new ATOM 0 HG3 LYS A 545 -3.032 7.922 -7.148 1.00 0.00 H new ATOM 0 HD2 LYS A 545 -1.552 8.523 -5.072 1.00 0.00 H new ATOM 0 HD3 LYS A 545 -0.203 7.993 -6.058 1.00 0.00 H new ATOM 0 HE2 LYS A 545 -2.210 10.160 -6.845 1.00 0.00 H new ATOM 0 HE3 LYS A 545 -0.601 10.461 -6.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 545 -0.494 10.667 -8.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 545 0.246 9.182 -8.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 545 -1.332 9.214 -8.800 1.00 0.00 H new ATOM 575 N LEU A 546 -2.610 3.124 -6.601 1.00 0.00 N ATOM 576 CA LEU A 546 -2.615 1.675 -6.407 1.00 0.00 C ATOM 577 C LEU A 546 -1.883 1.293 -5.116 1.00 0.00 C ATOM 578 O LEU A 546 -0.834 1.848 -4.791 1.00 0.00 O ATOM 579 CB LEU A 546 -2.017 1.025 -7.663 1.00 0.00 C ATOM 580 CG LEU A 546 -1.767 -0.490 -7.569 1.00 0.00 C ATOM 581 CD1 LEU A 546 -3.042 -1.329 -7.463 1.00 0.00 C ATOM 582 CD2 LEU A 546 -0.988 -0.982 -8.792 1.00 0.00 C ATOM 0 H LEU A 546 -1.745 3.480 -7.008 1.00 0.00 H new ATOM 0 HA LEU A 546 -3.632 1.303 -6.281 1.00 0.00 H new ATOM 0 HB2 LEU A 546 -2.686 1.214 -8.502 1.00 0.00 H new ATOM 0 HB3 LEU A 546 -1.072 1.518 -7.891 1.00 0.00 H new ATOM 0 HG LEU A 546 -1.200 -0.624 -6.648 1.00 0.00 H new ATOM 0 HD11 LEU A 546 -2.779 -2.385 -7.401 1.00 0.00 H new ATOM 0 HD12 LEU A 546 -3.595 -1.040 -6.569 1.00 0.00 H new ATOM 0 HD13 LEU A 546 -3.662 -1.161 -8.343 1.00 0.00 H new ATOM 0 HD21 LEU A 546 -0.820 -2.056 -8.709 1.00 0.00 H new ATOM 0 HD22 LEU A 546 -1.560 -0.773 -9.696 1.00 0.00 H new ATOM 0 HD23 LEU A 546 -0.028 -0.468 -8.843 1.00 0.00 H new ATOM 594 N MET A 547 -2.418 0.307 -4.397 1.00 0.00 N ATOM 595 CA MET A 547 -2.010 -0.050 -3.048 1.00 0.00 C ATOM 596 C MET A 547 -1.615 -1.535 -2.990 1.00 0.00 C ATOM 597 O MET A 547 -2.499 -2.391 -2.883 1.00 0.00 O ATOM 598 CB MET A 547 -3.164 0.286 -2.087 1.00 0.00 C ATOM 599 CG MET A 547 -2.664 0.932 -0.802 1.00 0.00 C ATOM 600 SD MET A 547 -3.998 1.133 0.393 1.00 0.00 S ATOM 601 CE MET A 547 -3.204 2.245 1.560 1.00 0.00 C ATOM 0 H MET A 547 -3.171 -0.281 -4.753 1.00 0.00 H new ATOM 0 HA MET A 547 -1.131 0.520 -2.746 1.00 0.00 H new ATOM 0 HB2 MET A 547 -3.865 0.958 -2.582 1.00 0.00 H new ATOM 0 HB3 MET A 547 -3.712 -0.625 -1.846 1.00 0.00 H new ATOM 0 HG2 MET A 547 -1.874 0.319 -0.368 1.00 0.00 H new ATOM 0 HG3 MET A 547 -2.226 1.904 -1.028 1.00 0.00 H new ATOM 0 HE1 MET A 547 -3.552 2.023 2.569 1.00 0.00 H new ATOM 0 HE2 MET A 547 -2.123 2.112 1.512 1.00 0.00 H new ATOM 0 HE3 MET A 547 -3.454 3.276 1.309 1.00 0.00 H new ATOM 611 N PRO A 548 -0.324 -1.896 -3.052 1.00 0.00 N ATOM 612 CA PRO A 548 0.088 -3.269 -2.794 1.00 0.00 C ATOM 613 C PRO A 548 -0.197 -3.600 -1.324 1.00 0.00 C ATOM 614 O PRO A 548 0.144 -2.820 -0.427 1.00 0.00 O ATOM 615 CB PRO A 548 1.573 -3.327 -3.154 1.00 0.00 C ATOM 616 CG PRO A 548 2.049 -1.891 -2.943 1.00 0.00 C ATOM 617 CD PRO A 548 0.825 -1.037 -3.276 1.00 0.00 C ATOM 0 HA PRO A 548 -0.453 -4.011 -3.382 1.00 0.00 H new ATOM 0 HB2 PRO A 548 2.113 -4.026 -2.516 1.00 0.00 H new ATOM 0 HB3 PRO A 548 1.724 -3.652 -4.183 1.00 0.00 H new ATOM 0 HG2 PRO A 548 2.381 -1.728 -1.918 1.00 0.00 H new ATOM 0 HG3 PRO A 548 2.891 -1.651 -3.593 1.00 0.00 H new ATOM 0 HD2 PRO A 548 0.781 -0.151 -2.643 1.00 0.00 H new ATOM 0 HD3 PRO A 548 0.859 -0.689 -4.308 1.00 0.00 H new ATOM 625 N ILE A 549 -0.838 -4.737 -1.063 1.00 0.00 N ATOM 626 CA ILE A 549 -1.202 -5.221 0.264 1.00 0.00 C ATOM 627 C ILE A 549 -0.926 -6.725 0.278 1.00 0.00 C ATOM 628 O ILE A 549 -0.973 -7.393 -0.753 1.00 0.00 O ATOM 629 CB ILE A 549 -2.685 -4.875 0.558 1.00 0.00 C ATOM 630 CG1 ILE A 549 -2.962 -3.364 0.644 1.00 0.00 C ATOM 631 CG2 ILE A 549 -3.263 -5.526 1.822 1.00 0.00 C ATOM 632 CD1 ILE A 549 -2.319 -2.603 1.799 1.00 0.00 C ATOM 0 H ILE A 549 -1.130 -5.373 -1.805 1.00 0.00 H new ATOM 0 HA ILE A 549 -0.619 -4.746 1.052 1.00 0.00 H new ATOM 0 HB ILE A 549 -3.189 -5.297 -0.312 1.00 0.00 H new ATOM 0 HG12 ILE A 549 -2.631 -2.906 -0.288 1.00 0.00 H new ATOM 0 HG13 ILE A 549 -4.041 -3.221 0.704 1.00 0.00 H new ATOM 0 HG21 ILE A 549 -4.304 -5.225 1.943 1.00 0.00 H new ATOM 0 HG22 ILE A 549 -3.207 -6.611 1.731 1.00 0.00 H new ATOM 0 HG23 ILE A 549 -2.689 -5.205 2.691 1.00 0.00 H new ATOM 0 HD11 ILE A 549 -2.596 -1.550 1.740 1.00 0.00 H new ATOM 0 HD12 ILE A 549 -2.666 -3.017 2.746 1.00 0.00 H new ATOM 0 HD13 ILE A 549 -1.235 -2.697 1.738 1.00 0.00 H new ATOM 644 N CYS A 550 -0.665 -7.263 1.464 1.00 0.00 N ATOM 645 CA CYS A 550 -0.418 -8.669 1.691 1.00 0.00 C ATOM 646 C CYS A 550 -1.509 -9.181 2.621 1.00 0.00 C ATOM 647 O CYS A 550 -1.576 -8.738 3.774 1.00 0.00 O ATOM 648 CB CYS A 550 0.969 -8.826 2.317 1.00 0.00 C ATOM 649 SG CYS A 550 1.592 -10.505 2.017 1.00 0.00 S ATOM 0 H CYS A 550 -0.620 -6.708 2.318 1.00 0.00 H new ATOM 0 HA CYS A 550 -0.438 -9.242 0.764 1.00 0.00 H new ATOM 0 HB2 CYS A 550 1.655 -8.093 1.893 1.00 0.00 H new ATOM 0 HB3 CYS A 550 0.919 -8.633 3.389 1.00 0.00 H new ATOM 0 HG CYS A 550 1.165 -10.927 0.864 1.00 0.00 H new ATOM 655 N MET A 551 -2.339 -10.108 2.139 1.00 0.00 N ATOM 656 CA MET A 551 -3.395 -10.757 2.911 1.00 0.00 C ATOM 657 C MET A 551 -2.870 -11.355 4.222 1.00 0.00 C ATOM 658 O MET A 551 -3.621 -11.415 5.193 1.00 0.00 O ATOM 659 CB MET A 551 -4.121 -11.809 2.048 1.00 0.00 C ATOM 660 CG MET A 551 -3.246 -13.010 1.643 1.00 0.00 C ATOM 661 SD MET A 551 -4.076 -14.332 0.712 1.00 0.00 S ATOM 662 CE MET A 551 -4.702 -13.435 -0.739 1.00 0.00 C ATOM 0 H MET A 551 -2.292 -10.435 1.174 1.00 0.00 H new ATOM 0 HA MET A 551 -4.119 -9.993 3.195 1.00 0.00 H new ATOM 0 HB2 MET A 551 -4.989 -12.175 2.596 1.00 0.00 H new ATOM 0 HB3 MET A 551 -4.495 -11.326 1.145 1.00 0.00 H new ATOM 0 HG2 MET A 551 -2.413 -12.641 1.044 1.00 0.00 H new ATOM 0 HG3 MET A 551 -2.820 -13.444 2.548 1.00 0.00 H new ATOM 0 HE1 MET A 551 -5.138 -14.143 -1.444 1.00 0.00 H new ATOM 0 HE2 MET A 551 -5.463 -12.720 -0.425 1.00 0.00 H new ATOM 0 HE3 MET A 551 -3.881 -12.903 -1.220 1.00 0.00 H new ATOM 672 N ASP A 552 -1.589 -11.741 4.264 1.00 0.00 N ATOM 673 CA ASP A 552 -0.847 -12.203 5.439 1.00 0.00 C ATOM 674 C ASP A 552 -1.099 -11.311 6.656 1.00 0.00 C ATOM 675 O ASP A 552 -1.321 -11.820 7.759 1.00 0.00 O ATOM 676 CB ASP A 552 0.645 -12.221 5.071 1.00 0.00 C ATOM 677 CG ASP A 552 1.600 -12.396 6.257 1.00 0.00 C ATOM 678 OD1 ASP A 552 1.932 -11.390 6.928 1.00 0.00 O ATOM 679 OD2 ASP A 552 2.129 -13.513 6.448 1.00 0.00 O ATOM 0 H ASP A 552 -1.009 -11.738 3.425 1.00 0.00 H new ATOM 0 HA ASP A 552 -1.184 -13.202 5.716 1.00 0.00 H new ATOM 0 HB2 ASP A 552 0.819 -13.029 4.361 1.00 0.00 H new ATOM 0 HB3 ASP A 552 0.890 -11.289 4.561 1.00 0.00 H new ATOM 684 N VAL A 553 -1.113 -9.989 6.463 1.00 0.00 N ATOM 685 CA VAL A 553 -1.252 -9.027 7.546 1.00 0.00 C ATOM 686 C VAL A 553 -2.735 -8.792 7.812 1.00 0.00 C ATOM 687 O VAL A 553 -3.304 -7.755 7.471 1.00 0.00 O ATOM 688 CB VAL A 553 -0.451 -7.737 7.281 1.00 0.00 C ATOM 689 CG1 VAL A 553 -0.253 -6.966 8.598 1.00 0.00 C ATOM 690 CG2 VAL A 553 0.931 -7.991 6.665 1.00 0.00 C ATOM 0 H VAL A 553 -1.027 -9.559 5.542 1.00 0.00 H new ATOM 0 HA VAL A 553 -0.813 -9.432 8.457 1.00 0.00 H new ATOM 0 HB VAL A 553 -1.036 -7.162 6.563 1.00 0.00 H new ATOM 0 HG11 VAL A 553 0.314 -6.055 8.405 1.00 0.00 H new ATOM 0 HG12 VAL A 553 -1.225 -6.706 9.017 1.00 0.00 H new ATOM 0 HG13 VAL A 553 0.293 -7.590 9.306 1.00 0.00 H new ATOM 0 HG21 VAL A 553 1.439 -7.040 6.506 1.00 0.00 H new ATOM 0 HG22 VAL A 553 1.522 -8.609 7.340 1.00 0.00 H new ATOM 0 HG23 VAL A 553 0.815 -8.505 5.711 1.00 0.00 H new ATOM 700 N ARG A 554 -3.374 -9.766 8.454 1.00 0.00 N ATOM 701 CA ARG A 554 -4.791 -9.730 8.794 1.00 0.00 C ATOM 702 C ARG A 554 -5.187 -8.469 9.563 1.00 0.00 C ATOM 703 O ARG A 554 -6.309 -8.017 9.373 1.00 0.00 O ATOM 704 CB ARG A 554 -5.149 -11.007 9.559 1.00 0.00 C ATOM 705 CG ARG A 554 -5.360 -12.216 8.638 1.00 0.00 C ATOM 706 CD ARG A 554 -6.732 -12.175 7.936 1.00 0.00 C ATOM 707 NE ARG A 554 -7.408 -13.482 8.001 1.00 0.00 N ATOM 708 CZ ARG A 554 -8.202 -14.074 7.101 1.00 0.00 C ATOM 709 NH1 ARG A 554 -8.272 -13.646 5.846 1.00 0.00 N ATOM 710 NH2 ARG A 554 -8.926 -15.112 7.500 1.00 0.00 N ATOM 0 H ARG A 554 -2.909 -10.621 8.759 1.00 0.00 H new ATOM 0 HA ARG A 554 -5.367 -9.689 7.870 1.00 0.00 H new ATOM 0 HB2 ARG A 554 -4.355 -11.233 10.270 1.00 0.00 H new ATOM 0 HB3 ARG A 554 -6.056 -10.835 10.138 1.00 0.00 H new ATOM 0 HG2 ARG A 554 -4.570 -12.243 7.888 1.00 0.00 H new ATOM 0 HG3 ARG A 554 -5.278 -13.134 9.220 1.00 0.00 H new ATOM 0 HD2 ARG A 554 -7.359 -11.416 8.403 1.00 0.00 H new ATOM 0 HD3 ARG A 554 -6.601 -11.883 6.894 1.00 0.00 H new ATOM 0 HE ARG A 554 -7.248 -14.013 8.857 1.00 0.00 H new ATOM 0 HH11 ARG A 554 -7.712 -12.847 5.548 1.00 0.00 H new ATOM 0 HH12 ARG A 554 -8.886 -14.116 5.180 1.00 0.00 H new ATOM 0 HH21 ARG A 554 -8.866 -15.434 8.466 1.00 0.00 H new ATOM 0 HH22 ARG A 554 -9.542 -15.588 6.841 1.00 0.00 H new ATOM 724 N ALA A 555 -4.293 -7.836 10.332 1.00 0.00 N ATOM 725 CA ALA A 555 -4.572 -6.562 10.998 1.00 0.00 C ATOM 726 C ALA A 555 -4.947 -5.452 10.004 1.00 0.00 C ATOM 727 O ALA A 555 -5.885 -4.680 10.224 1.00 0.00 O ATOM 728 CB ALA A 555 -3.341 -6.147 11.816 1.00 0.00 C ATOM 0 H ALA A 555 -3.355 -8.195 10.509 1.00 0.00 H new ATOM 0 HA ALA A 555 -5.432 -6.703 11.652 1.00 0.00 H new ATOM 0 HB1 ALA A 555 -3.539 -5.199 12.316 1.00 0.00 H new ATOM 0 HB2 ALA A 555 -3.125 -6.912 12.562 1.00 0.00 H new ATOM 0 HB3 ALA A 555 -2.484 -6.035 11.152 1.00 0.00 H new ATOM 734 N ILE A 556 -4.201 -5.359 8.902 1.00 0.00 N ATOM 735 CA ILE A 556 -4.468 -4.432 7.807 1.00 0.00 C ATOM 736 C ILE A 556 -5.814 -4.824 7.182 1.00 0.00 C ATOM 737 O ILE A 556 -6.680 -3.965 6.977 1.00 0.00 O ATOM 738 CB ILE A 556 -3.251 -4.462 6.841 1.00 0.00 C ATOM 739 CG1 ILE A 556 -2.073 -3.701 7.494 1.00 0.00 C ATOM 740 CG2 ILE A 556 -3.533 -3.922 5.433 1.00 0.00 C ATOM 741 CD1 ILE A 556 -0.738 -3.878 6.764 1.00 0.00 C ATOM 0 H ILE A 556 -3.377 -5.940 8.745 1.00 0.00 H new ATOM 0 HA ILE A 556 -4.570 -3.394 8.125 1.00 0.00 H new ATOM 0 HB ILE A 556 -3.001 -5.512 6.688 1.00 0.00 H new ATOM 0 HG12 ILE A 556 -2.316 -2.639 7.533 1.00 0.00 H new ATOM 0 HG13 ILE A 556 -1.960 -4.040 8.524 1.00 0.00 H new ATOM 0 HG21 ILE A 556 -2.626 -3.983 4.832 1.00 0.00 H new ATOM 0 HG22 ILE A 556 -4.319 -4.516 4.966 1.00 0.00 H new ATOM 0 HG23 ILE A 556 -3.855 -2.883 5.500 1.00 0.00 H new ATOM 0 HD11 ILE A 556 0.038 -3.314 7.282 1.00 0.00 H new ATOM 0 HD12 ILE A 556 -0.469 -4.934 6.748 1.00 0.00 H new ATOM 0 HD13 ILE A 556 -0.831 -3.511 5.742 1.00 0.00 H new ATOM 753 N MET A 557 -6.016 -6.118 6.924 1.00 0.00 N ATOM 754 CA MET A 557 -7.198 -6.610 6.229 1.00 0.00 C ATOM 755 C MET A 557 -8.471 -6.344 7.034 1.00 0.00 C ATOM 756 O MET A 557 -9.469 -5.912 6.457 1.00 0.00 O ATOM 757 CB MET A 557 -7.067 -8.102 5.876 1.00 0.00 C ATOM 758 CG MET A 557 -5.750 -8.508 5.195 1.00 0.00 C ATOM 759 SD MET A 557 -5.103 -7.333 3.981 1.00 0.00 S ATOM 760 CE MET A 557 -6.469 -7.379 2.808 1.00 0.00 C ATOM 0 H MET A 557 -5.361 -6.852 7.193 1.00 0.00 H new ATOM 0 HA MET A 557 -7.276 -6.056 5.293 1.00 0.00 H new ATOM 0 HB2 MET A 557 -7.178 -8.685 6.790 1.00 0.00 H new ATOM 0 HB3 MET A 557 -7.894 -8.376 5.221 1.00 0.00 H new ATOM 0 HG2 MET A 557 -4.995 -8.659 5.966 1.00 0.00 H new ATOM 0 HG3 MET A 557 -5.898 -9.468 4.701 1.00 0.00 H new ATOM 0 HE1 MET A 557 -6.506 -6.440 2.255 1.00 0.00 H new ATOM 0 HE2 MET A 557 -6.323 -8.205 2.112 1.00 0.00 H new ATOM 0 HE3 MET A 557 -7.406 -7.520 3.346 1.00 0.00 H new ATOM 770 N ALA A 558 -8.433 -6.525 8.356 1.00 0.00 N ATOM 771 CA ALA A 558 -9.554 -6.327 9.265 1.00 0.00 C ATOM 772 C ALA A 558 -10.001 -4.862 9.334 1.00 0.00 C ATOM 773 O ALA A 558 -11.107 -4.593 9.809 1.00 0.00 O ATOM 774 CB ALA A 558 -9.164 -6.835 10.658 1.00 0.00 C ATOM 0 H ALA A 558 -7.585 -6.825 8.837 1.00 0.00 H new ATOM 0 HA ALA A 558 -10.403 -6.893 8.883 1.00 0.00 H new ATOM 0 HB1 ALA A 558 -9.998 -6.690 11.345 1.00 0.00 H new ATOM 0 HB2 ALA A 558 -8.919 -7.896 10.603 1.00 0.00 H new ATOM 0 HB3 ALA A 558 -8.297 -6.281 11.018 1.00 0.00 H new ATOM 780 N THR A 559 -9.177 -3.922 8.861 1.00 0.00 N ATOM 781 CA THR A 559 -9.570 -2.539 8.650 1.00 0.00 C ATOM 782 C THR A 559 -10.154 -2.392 7.243 1.00 0.00 C ATOM 783 O THR A 559 -11.289 -1.930 7.117 1.00 0.00 O ATOM 784 CB THR A 559 -8.358 -1.620 8.881 1.00 0.00 C ATOM 785 OG1 THR A 559 -7.811 -1.850 10.168 1.00 0.00 O ATOM 786 CG2 THR A 559 -8.743 -0.139 8.788 1.00 0.00 C ATOM 0 H THR A 559 -8.206 -4.110 8.613 1.00 0.00 H new ATOM 0 HA THR A 559 -10.342 -2.244 9.361 1.00 0.00 H new ATOM 0 HB THR A 559 -7.630 -1.850 8.103 1.00 0.00 H new ATOM 0 HG1 THR A 559 -7.039 -1.262 10.305 1.00 0.00 H new ATOM 0 HG21 THR A 559 -7.860 0.478 8.957 1.00 0.00 H new ATOM 0 HG22 THR A 559 -9.148 0.070 7.798 1.00 0.00 H new ATOM 0 HG23 THR A 559 -9.495 0.090 9.543 1.00 0.00 H new ATOM 794 N ILE A 560 -9.410 -2.780 6.194 1.00 0.00 N ATOM 795 CA ILE A 560 -9.837 -2.614 4.803 1.00 0.00 C ATOM 796 C ILE A 560 -11.215 -3.247 4.619 1.00 0.00 C ATOM 797 O ILE A 560 -12.174 -2.548 4.307 1.00 0.00 O ATOM 798 CB ILE A 560 -8.807 -3.207 3.815 1.00 0.00 C ATOM 799 CG1 ILE A 560 -7.459 -2.461 3.864 1.00 0.00 C ATOM 800 CG2 ILE A 560 -9.343 -3.144 2.372 1.00 0.00 C ATOM 801 CD1 ILE A 560 -6.328 -3.315 3.273 1.00 0.00 C ATOM 0 H ILE A 560 -8.494 -3.218 6.292 1.00 0.00 H new ATOM 0 HA ILE A 560 -9.902 -1.549 4.581 1.00 0.00 H new ATOM 0 HB ILE A 560 -8.648 -4.242 4.118 1.00 0.00 H new ATOM 0 HG12 ILE A 560 -7.538 -1.525 3.311 1.00 0.00 H new ATOM 0 HG13 ILE A 560 -7.221 -2.202 4.896 1.00 0.00 H new ATOM 0 HG21 ILE A 560 -8.604 -3.566 1.691 1.00 0.00 H new ATOM 0 HG22 ILE A 560 -10.269 -3.715 2.302 1.00 0.00 H new ATOM 0 HG23 ILE A 560 -9.536 -2.106 2.101 1.00 0.00 H new ATOM 0 HD11 ILE A 560 -5.390 -2.761 3.322 1.00 0.00 H new ATOM 0 HD12 ILE A 560 -6.234 -4.239 3.843 1.00 0.00 H new ATOM 0 HD13 ILE A 560 -6.556 -3.552 2.234 1.00 0.00 H new ATOM 813 N GLN A 561 -11.341 -4.556 4.840 1.00 0.00 N ATOM 814 CA GLN A 561 -12.565 -5.269 4.516 1.00 0.00 C ATOM 815 C GLN A 561 -13.778 -4.704 5.285 1.00 0.00 C ATOM 816 O GLN A 561 -14.916 -4.886 4.853 1.00 0.00 O ATOM 817 CB GLN A 561 -12.413 -6.762 4.801 1.00 0.00 C ATOM 818 CG GLN A 561 -11.308 -7.483 4.008 1.00 0.00 C ATOM 819 CD GLN A 561 -11.475 -8.968 4.249 1.00 0.00 C ATOM 820 OE1 GLN A 561 -10.846 -9.558 5.121 1.00 0.00 O ATOM 821 NE2 GLN A 561 -12.324 -9.620 3.475 1.00 0.00 N ATOM 0 H GLN A 561 -10.607 -5.139 5.242 1.00 0.00 H new ATOM 0 HA GLN A 561 -12.748 -5.127 3.451 1.00 0.00 H new ATOM 0 HB2 GLN A 561 -12.215 -6.892 5.865 1.00 0.00 H new ATOM 0 HB3 GLN A 561 -13.364 -7.252 4.592 1.00 0.00 H new ATOM 0 HG2 GLN A 561 -11.387 -7.255 2.945 1.00 0.00 H new ATOM 0 HG3 GLN A 561 -10.322 -7.150 4.333 1.00 0.00 H new ATOM 0 HE21 GLN A 561 -12.843 -9.120 2.753 1.00 0.00 H new ATOM 0 HE22 GLN A 561 -12.461 -10.623 3.600 1.00 0.00 H new ATOM 830 N ARG A 562 -13.570 -4.019 6.421 1.00 0.00 N ATOM 831 CA ARG A 562 -14.619 -3.362 7.188 1.00 0.00 C ATOM 832 C ARG A 562 -14.967 -1.977 6.633 1.00 0.00 C ATOM 833 O ARG A 562 -16.137 -1.590 6.676 1.00 0.00 O ATOM 834 CB ARG A 562 -14.142 -3.297 8.644 1.00 0.00 C ATOM 835 CG ARG A 562 -15.234 -2.782 9.580 1.00 0.00 C ATOM 836 CD ARG A 562 -14.807 -2.975 11.032 1.00 0.00 C ATOM 837 NE ARG A 562 -15.909 -2.694 11.968 1.00 0.00 N ATOM 838 CZ ARG A 562 -15.826 -2.701 13.302 1.00 0.00 C ATOM 839 NH1 ARG A 562 -14.645 -2.698 13.911 1.00 0.00 N ATOM 840 NH2 ARG A 562 -16.935 -2.717 14.034 1.00 0.00 N ATOM 0 H ARG A 562 -12.644 -3.909 6.834 1.00 0.00 H new ATOM 0 HA ARG A 562 -15.545 -3.932 7.118 1.00 0.00 H new ATOM 0 HB2 ARG A 562 -13.826 -4.289 8.967 1.00 0.00 H new ATOM 0 HB3 ARG A 562 -13.270 -2.647 8.711 1.00 0.00 H new ATOM 0 HG2 ARG A 562 -15.424 -1.727 9.385 1.00 0.00 H new ATOM 0 HG3 ARG A 562 -16.167 -3.314 9.392 1.00 0.00 H new ATOM 0 HD2 ARG A 562 -14.460 -3.998 11.176 1.00 0.00 H new ATOM 0 HD3 ARG A 562 -13.965 -2.319 11.254 1.00 0.00 H new ATOM 0 HE ARG A 562 -16.818 -2.474 11.561 1.00 0.00 H new ATOM 0 HH11 ARG A 562 -13.787 -2.690 13.360 1.00 0.00 H new ATOM 0 HH12 ARG A 562 -14.597 -2.703 14.930 1.00 0.00 H new ATOM 0 HH21 ARG A 562 -17.847 -2.724 13.578 1.00 0.00 H new ATOM 0 HH22 ARG A 562 -16.874 -2.722 15.052 1.00 0.00 H new ATOM 854 N LYS A 563 -13.984 -1.210 6.149 1.00 0.00 N ATOM 855 CA LYS A 563 -14.185 0.102 5.516 1.00 0.00 C ATOM 856 C LYS A 563 -14.874 -0.031 4.155 1.00 0.00 C ATOM 857 O LYS A 563 -15.551 0.897 3.703 1.00 0.00 O ATOM 858 CB LYS A 563 -12.817 0.793 5.350 1.00 0.00 C ATOM 859 CG LYS A 563 -12.944 2.279 4.970 1.00 0.00 C ATOM 860 CD LYS A 563 -11.636 3.056 5.168 1.00 0.00 C ATOM 861 CE LYS A 563 -11.752 4.439 4.520 1.00 0.00 C ATOM 862 NZ LYS A 563 -10.659 5.365 4.886 1.00 0.00 N ATOM 0 H LYS A 563 -13.004 -1.489 6.186 1.00 0.00 H new ATOM 0 HA LYS A 563 -14.833 0.701 6.155 1.00 0.00 H new ATOM 0 HB2 LYS A 563 -12.256 0.707 6.280 1.00 0.00 H new ATOM 0 HB3 LYS A 563 -12.243 0.274 4.582 1.00 0.00 H new ATOM 0 HG2 LYS A 563 -13.254 2.358 3.928 1.00 0.00 H new ATOM 0 HG3 LYS A 563 -13.729 2.738 5.572 1.00 0.00 H new ATOM 0 HD2 LYS A 563 -11.421 3.159 6.232 1.00 0.00 H new ATOM 0 HD3 LYS A 563 -10.805 2.506 4.727 1.00 0.00 H new ATOM 0 HE2 LYS A 563 -11.768 4.322 3.436 1.00 0.00 H new ATOM 0 HE3 LYS A 563 -12.704 4.885 4.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 563 -10.804 6.279 4.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 563 -10.655 5.507 5.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 563 -9.748 4.961 4.589 1.00 0.00 H new ATOM 876 N TYR A 564 -14.689 -1.178 3.507 1.00 0.00 N ATOM 877 CA TYR A 564 -15.138 -1.479 2.164 1.00 0.00 C ATOM 878 C TYR A 564 -15.912 -2.792 2.249 1.00 0.00 C ATOM 879 O TYR A 564 -15.369 -3.851 1.949 1.00 0.00 O ATOM 880 CB TYR A 564 -13.908 -1.558 1.243 1.00 0.00 C ATOM 881 CG TYR A 564 -13.041 -0.311 1.207 1.00 0.00 C ATOM 882 CD1 TYR A 564 -13.357 0.725 0.317 1.00 0.00 C ATOM 883 CD2 TYR A 564 -11.922 -0.178 2.053 1.00 0.00 C ATOM 884 CE1 TYR A 564 -12.575 1.892 0.289 1.00 0.00 C ATOM 885 CE2 TYR A 564 -11.147 0.991 2.051 1.00 0.00 C ATOM 886 CZ TYR A 564 -11.504 2.059 1.199 1.00 0.00 C ATOM 887 OH TYR A 564 -10.865 3.252 1.319 1.00 0.00 O ATOM 0 H TYR A 564 -14.194 -1.961 3.934 1.00 0.00 H new ATOM 0 HA TYR A 564 -15.793 -0.714 1.746 1.00 0.00 H new ATOM 0 HB2 TYR A 564 -13.292 -2.400 1.559 1.00 0.00 H new ATOM 0 HB3 TYR A 564 -14.247 -1.774 0.230 1.00 0.00 H new ATOM 0 HD1 TYR A 564 -14.202 0.626 -0.348 1.00 0.00 H new ATOM 0 HD2 TYR A 564 -11.657 -0.990 2.714 1.00 0.00 H new ATOM 0 HE1 TYR A 564 -12.793 2.667 -0.432 1.00 0.00 H new ATOM 0 HE2 TYR A 564 -10.284 1.074 2.696 1.00 0.00 H new ATOM 0 HH TYR A 564 -11.473 3.976 1.061 1.00 0.00 H new ATOM 897 N LYS A 565 -17.137 -2.750 2.780 1.00 0.00 N ATOM 898 CA LYS A 565 -17.847 -3.935 3.236 1.00 0.00 C ATOM 899 C LYS A 565 -18.086 -4.964 2.131 1.00 0.00 C ATOM 900 O LYS A 565 -18.048 -4.664 0.940 1.00 0.00 O ATOM 901 CB LYS A 565 -19.113 -3.511 3.986 1.00 0.00 C ATOM 902 CG LYS A 565 -20.289 -3.275 3.038 1.00 0.00 C ATOM 903 CD LYS A 565 -21.616 -3.001 3.753 1.00 0.00 C ATOM 904 CE LYS A 565 -22.019 -4.229 4.576 1.00 0.00 C ATOM 905 NZ LYS A 565 -23.422 -4.174 5.010 1.00 0.00 N ATOM 0 H LYS A 565 -17.662 -1.884 2.904 1.00 0.00 H new ATOM 0 HA LYS A 565 -17.211 -4.473 3.939 1.00 0.00 H new ATOM 0 HB2 LYS A 565 -19.380 -4.281 4.710 1.00 0.00 H new ATOM 0 HB3 LYS A 565 -18.913 -2.599 4.549 1.00 0.00 H new ATOM 0 HG2 LYS A 565 -20.056 -2.431 2.389 1.00 0.00 H new ATOM 0 HG3 LYS A 565 -20.407 -4.148 2.396 1.00 0.00 H new ATOM 0 HD2 LYS A 565 -21.518 -2.131 4.403 1.00 0.00 H new ATOM 0 HD3 LYS A 565 -22.392 -2.768 3.024 1.00 0.00 H new ATOM 0 HE2 LYS A 565 -21.860 -5.129 3.983 1.00 0.00 H new ATOM 0 HE3 LYS A 565 -21.373 -4.305 5.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 565 -23.648 -5.025 5.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 565 -23.570 -3.329 5.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 565 -24.042 -4.128 4.176 1.00 0.00 H new ATOM 919 N GLY A 566 -18.425 -6.188 2.535 1.00 0.00 N ATOM 920 CA GLY A 566 -18.905 -7.233 1.639 1.00 0.00 C ATOM 921 C GLY A 566 -17.782 -7.970 0.915 1.00 0.00 C ATOM 922 O GLY A 566 -17.978 -9.098 0.465 1.00 0.00 O ATOM 0 H GLY A 566 -18.372 -6.483 3.510 1.00 0.00 H new ATOM 0 HA2 GLY A 566 -19.492 -7.951 2.211 1.00 0.00 H new ATOM 0 HA3 GLY A 566 -19.574 -6.790 0.901 1.00 0.00 H new ATOM 926 N ILE A 567 -16.600 -7.374 0.803 1.00 0.00 N ATOM 927 CA ILE A 567 -15.404 -7.999 0.263 1.00 0.00 C ATOM 928 C ILE A 567 -14.971 -9.158 1.184 1.00 0.00 C ATOM 929 O ILE A 567 -15.062 -9.035 2.412 1.00 0.00 O ATOM 930 CB ILE A 567 -14.363 -6.873 0.130 1.00 0.00 C ATOM 931 CG1 ILE A 567 -13.194 -7.271 -0.772 1.00 0.00 C ATOM 932 CG2 ILE A 567 -13.863 -6.383 1.492 1.00 0.00 C ATOM 933 CD1 ILE A 567 -12.047 -6.257 -0.727 1.00 0.00 C ATOM 0 H ILE A 567 -16.446 -6.409 1.097 1.00 0.00 H new ATOM 0 HA ILE A 567 -15.553 -8.454 -0.716 1.00 0.00 H new ATOM 0 HB ILE A 567 -14.877 -6.040 -0.349 1.00 0.00 H new ATOM 0 HG12 ILE A 567 -12.822 -8.249 -0.468 1.00 0.00 H new ATOM 0 HG13 ILE A 567 -13.548 -7.369 -1.798 1.00 0.00 H new ATOM 0 HG21 ILE A 567 -13.131 -5.589 1.347 1.00 0.00 H new ATOM 0 HG22 ILE A 567 -14.703 -6.000 2.072 1.00 0.00 H new ATOM 0 HG23 ILE A 567 -13.399 -7.211 2.029 1.00 0.00 H new ATOM 0 HD11 ILE A 567 -11.243 -6.587 -1.385 1.00 0.00 H new ATOM 0 HD12 ILE A 567 -12.409 -5.283 -1.057 1.00 0.00 H new ATOM 0 HD13 ILE A 567 -11.671 -6.178 0.293 1.00 0.00 H new ATOM 945 N LYS A 568 -14.439 -10.267 0.649 1.00 0.00 N ATOM 946 CA LYS A 568 -14.119 -11.455 1.464 1.00 0.00 C ATOM 947 C LYS A 568 -12.752 -12.070 1.129 1.00 0.00 C ATOM 948 O LYS A 568 -12.598 -13.284 1.147 1.00 0.00 O ATOM 949 CB LYS A 568 -15.302 -12.443 1.363 1.00 0.00 C ATOM 950 CG LYS A 568 -15.289 -13.521 2.465 1.00 0.00 C ATOM 951 CD LYS A 568 -16.699 -13.820 2.982 1.00 0.00 C ATOM 952 CE LYS A 568 -16.669 -14.949 4.016 1.00 0.00 C ATOM 953 NZ LYS A 568 -17.874 -14.935 4.872 1.00 0.00 N ATOM 0 H LYS A 568 -14.221 -10.369 -0.342 1.00 0.00 H new ATOM 0 HA LYS A 568 -14.003 -11.162 2.507 1.00 0.00 H new ATOM 0 HB2 LYS A 568 -16.238 -11.886 1.419 1.00 0.00 H new ATOM 0 HB3 LYS A 568 -15.279 -12.929 0.388 1.00 0.00 H new ATOM 0 HG2 LYS A 568 -14.843 -14.436 2.074 1.00 0.00 H new ATOM 0 HG3 LYS A 568 -14.661 -13.189 3.292 1.00 0.00 H new ATOM 0 HD2 LYS A 568 -17.126 -12.922 3.429 1.00 0.00 H new ATOM 0 HD3 LYS A 568 -17.345 -14.100 2.150 1.00 0.00 H new ATOM 0 HE2 LYS A 568 -16.596 -15.909 3.505 1.00 0.00 H new ATOM 0 HE3 LYS A 568 -15.779 -14.850 4.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 568 -17.820 -15.713 5.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 568 -17.930 -14.028 5.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 568 -18.721 -15.054 4.281 1.00 0.00 H new ATOM 967 N ILE A 569 -11.737 -11.217 0.968 1.00 0.00 N ATOM 968 CA ILE A 569 -10.388 -11.468 0.453 1.00 0.00 C ATOM 969 C ILE A 569 -10.395 -12.204 -0.888 1.00 0.00 C ATOM 970 O ILE A 569 -11.237 -13.052 -1.181 1.00 0.00 O ATOM 971 CB ILE A 569 -9.439 -12.078 1.511 1.00 0.00 C ATOM 972 CG1 ILE A 569 -9.341 -11.214 2.782 1.00 0.00 C ATOM 973 CG2 ILE A 569 -8.009 -12.233 0.966 1.00 0.00 C ATOM 974 CD1 ILE A 569 -9.012 -9.731 2.523 1.00 0.00 C ATOM 0 H ILE A 569 -11.851 -10.235 1.220 1.00 0.00 H new ATOM 0 HA ILE A 569 -9.956 -10.492 0.233 1.00 0.00 H new ATOM 0 HB ILE A 569 -9.871 -13.049 1.753 1.00 0.00 H new ATOM 0 HG12 ILE A 569 -10.287 -11.275 3.321 1.00 0.00 H new ATOM 0 HG13 ILE A 569 -8.575 -11.634 3.434 1.00 0.00 H new ATOM 0 HG21 ILE A 569 -7.371 -12.664 1.737 1.00 0.00 H new ATOM 0 HG22 ILE A 569 -8.021 -12.889 0.095 1.00 0.00 H new ATOM 0 HG23 ILE A 569 -7.621 -11.256 0.679 1.00 0.00 H new ATOM 0 HD11 ILE A 569 -8.962 -9.198 3.473 1.00 0.00 H new ATOM 0 HD12 ILE A 569 -8.051 -9.655 2.014 1.00 0.00 H new ATOM 0 HD13 ILE A 569 -9.789 -9.289 1.899 1.00 0.00 H new ATOM 986 N GLN A 570 -9.450 -11.800 -1.726 1.00 0.00 N ATOM 987 CA GLN A 570 -9.250 -12.214 -3.096 1.00 0.00 C ATOM 988 C GLN A 570 -7.734 -12.320 -3.283 1.00 0.00 C ATOM 989 O GLN A 570 -6.985 -12.107 -2.328 1.00 0.00 O ATOM 990 CB GLN A 570 -9.856 -11.168 -4.046 1.00 0.00 C ATOM 991 CG GLN A 570 -11.214 -10.578 -3.621 1.00 0.00 C ATOM 992 CD GLN A 570 -11.110 -9.151 -3.096 1.00 0.00 C ATOM 993 OE1 GLN A 570 -10.805 -8.875 -1.824 1.00 0.00 O flip ATOM 994 NE2 GLN A 570 -11.342 -8.232 -3.870 1.00 0.00 N flip ATOM 0 H GLN A 570 -8.749 -11.118 -1.435 1.00 0.00 H new ATOM 0 HA GLN A 570 -9.735 -13.165 -3.316 1.00 0.00 H new ATOM 0 HB2 GLN A 570 -9.145 -10.349 -4.155 1.00 0.00 H new ATOM 0 HB3 GLN A 570 -9.972 -11.623 -5.030 1.00 0.00 H new ATOM 0 HG2 GLN A 570 -11.894 -10.596 -4.473 1.00 0.00 H new ATOM 0 HG3 GLN A 570 -11.653 -11.211 -2.850 1.00 0.00 H new ATOM 0 HE21 GLN A 570 -11.576 -8.431 -4.843 1.00 0.00 H new ATOM 0 HE22 GLN A 570 -11.302 -7.267 -3.542 1.00 0.00 H new ATOM 1003 N GLU A 571 -7.275 -12.559 -4.502 1.00 0.00 N ATOM 1004 CA GLU A 571 -5.887 -12.353 -4.886 1.00 0.00 C ATOM 1005 C GLU A 571 -5.866 -11.321 -6.012 1.00 0.00 C ATOM 1006 O GLU A 571 -6.923 -10.974 -6.551 1.00 0.00 O ATOM 1007 CB GLU A 571 -5.283 -13.690 -5.334 1.00 0.00 C ATOM 1008 CG GLU A 571 -3.839 -13.869 -4.870 1.00 0.00 C ATOM 1009 CD GLU A 571 -3.244 -15.148 -5.461 1.00 0.00 C ATOM 1010 OE1 GLU A 571 -3.798 -16.238 -5.179 1.00 0.00 O ATOM 1011 OE2 GLU A 571 -2.241 -15.052 -6.196 1.00 0.00 O ATOM 0 H GLU A 571 -7.862 -12.905 -5.261 1.00 0.00 H new ATOM 0 HA GLU A 571 -5.291 -11.985 -4.051 1.00 0.00 H new ATOM 0 HB2 GLU A 571 -5.890 -14.507 -4.944 1.00 0.00 H new ATOM 0 HB3 GLU A 571 -5.322 -13.755 -6.421 1.00 0.00 H new ATOM 0 HG2 GLU A 571 -3.243 -13.009 -5.175 1.00 0.00 H new ATOM 0 HG3 GLU A 571 -3.803 -13.913 -3.781 1.00 0.00 H new ATOM 1018 N GLY A 572 -4.676 -10.875 -6.407 1.00 0.00 N ATOM 1019 CA GLY A 572 -4.536 -10.111 -7.635 1.00 0.00 C ATOM 1020 C GLY A 572 -4.875 -8.646 -7.456 1.00 0.00 C ATOM 1021 O GLY A 572 -4.879 -8.108 -6.348 1.00 0.00 O ATOM 0 H GLY A 572 -3.806 -11.029 -5.898 1.00 0.00 H new ATOM 0 HA2 GLY A 572 -3.512 -10.201 -7.999 1.00 0.00 H new ATOM 0 HA3 GLY A 572 -5.185 -10.539 -8.400 1.00 0.00 H new ATOM 1025 N ILE A 573 -5.060 -7.965 -8.580 1.00 0.00 N ATOM 1026 CA ILE A 573 -5.449 -6.568 -8.618 1.00 0.00 C ATOM 1027 C ILE A 573 -6.888 -6.492 -8.107 1.00 0.00 C ATOM 1028 O ILE A 573 -7.838 -6.852 -8.804 1.00 0.00 O ATOM 1029 CB ILE A 573 -5.222 -6.008 -10.032 1.00 0.00 C ATOM 1030 CG1 ILE A 573 -3.696 -5.882 -10.257 1.00 0.00 C ATOM 1031 CG2 ILE A 573 -5.923 -4.646 -10.199 1.00 0.00 C ATOM 1032 CD1 ILE A 573 -3.284 -5.523 -11.685 1.00 0.00 C ATOM 0 H ILE A 573 -4.941 -8.379 -9.505 1.00 0.00 H new ATOM 0 HA ILE A 573 -4.842 -5.934 -7.972 1.00 0.00 H new ATOM 0 HB ILE A 573 -5.650 -6.680 -10.776 1.00 0.00 H new ATOM 0 HG12 ILE A 573 -3.305 -5.123 -9.580 1.00 0.00 H new ATOM 0 HG13 ILE A 573 -3.224 -6.826 -9.984 1.00 0.00 H new ATOM 0 HG21 ILE A 573 -5.749 -4.268 -11.207 1.00 0.00 H new ATOM 0 HG22 ILE A 573 -6.994 -4.766 -10.036 1.00 0.00 H new ATOM 0 HG23 ILE A 573 -5.522 -3.939 -9.473 1.00 0.00 H new ATOM 0 HD11 ILE A 573 -2.198 -5.457 -11.745 1.00 0.00 H new ATOM 0 HD12 ILE A 573 -3.639 -6.293 -12.370 1.00 0.00 H new ATOM 0 HD13 ILE A 573 -3.721 -4.563 -11.959 1.00 0.00 H new ATOM 1044 N VAL A 574 -7.035 -6.023 -6.874 1.00 0.00 N ATOM 1045 CA VAL A 574 -8.302 -5.891 -6.193 1.00 0.00 C ATOM 1046 C VAL A 574 -8.778 -4.460 -6.364 1.00 0.00 C ATOM 1047 O VAL A 574 -8.469 -3.557 -5.599 1.00 0.00 O ATOM 1048 CB VAL A 574 -8.168 -6.393 -4.734 1.00 0.00 C ATOM 1049 CG1 VAL A 574 -9.307 -5.923 -3.817 1.00 0.00 C ATOM 1050 CG2 VAL A 574 -8.099 -7.925 -4.698 1.00 0.00 C ATOM 0 H VAL A 574 -6.244 -5.716 -6.308 1.00 0.00 H new ATOM 0 HA VAL A 574 -9.080 -6.522 -6.622 1.00 0.00 H new ATOM 0 HB VAL A 574 -7.244 -5.958 -4.354 1.00 0.00 H new ATOM 0 HG11 VAL A 574 -9.148 -6.312 -2.811 1.00 0.00 H new ATOM 0 HG12 VAL A 574 -9.324 -4.834 -3.787 1.00 0.00 H new ATOM 0 HG13 VAL A 574 -10.259 -6.290 -4.202 1.00 0.00 H new ATOM 0 HG21 VAL A 574 -8.005 -8.261 -3.665 1.00 0.00 H new ATOM 0 HG22 VAL A 574 -9.008 -8.340 -5.133 1.00 0.00 H new ATOM 0 HG23 VAL A 574 -7.235 -8.264 -5.270 1.00 0.00 H new ATOM 1060 N ASP A 575 -9.568 -4.252 -7.403 1.00 0.00 N ATOM 1061 CA ASP A 575 -10.452 -3.106 -7.489 1.00 0.00 C ATOM 1062 C ASP A 575 -11.573 -3.297 -6.465 1.00 0.00 C ATOM 1063 O ASP A 575 -12.542 -4.015 -6.744 1.00 0.00 O ATOM 1064 CB ASP A 575 -10.974 -3.022 -8.919 1.00 0.00 C ATOM 1065 CG ASP A 575 -12.092 -1.991 -9.073 1.00 0.00 C ATOM 1066 OD1 ASP A 575 -12.110 -0.983 -8.328 1.00 0.00 O ATOM 1067 OD2 ASP A 575 -12.992 -2.238 -9.908 1.00 0.00 O ATOM 0 H ASP A 575 -9.614 -4.874 -8.210 1.00 0.00 H new ATOM 0 HA ASP A 575 -9.945 -2.169 -7.261 1.00 0.00 H new ATOM 0 HB2 ASP A 575 -10.153 -2.765 -9.588 1.00 0.00 H new ATOM 0 HB3 ASP A 575 -11.342 -4.001 -9.227 1.00 0.00 H new ATOM 1072 N TYR A 576 -11.413 -2.757 -5.254 1.00 0.00 N ATOM 1073 CA TYR A 576 -12.473 -2.723 -4.255 1.00 0.00 C ATOM 1074 C TYR A 576 -12.311 -1.450 -3.420 1.00 0.00 C ATOM 1075 O TYR A 576 -11.667 -1.449 -2.367 1.00 0.00 O ATOM 1076 CB TYR A 576 -12.552 -4.034 -3.436 1.00 0.00 C ATOM 1077 CG TYR A 576 -13.958 -4.362 -2.975 1.00 0.00 C ATOM 1078 CD1 TYR A 576 -14.592 -3.548 -2.021 1.00 0.00 C ATOM 1079 CD2 TYR A 576 -14.639 -5.478 -3.493 1.00 0.00 C ATOM 1080 CE1 TYR A 576 -15.891 -3.846 -1.574 1.00 0.00 C ATOM 1081 CE2 TYR A 576 -15.950 -5.767 -3.079 1.00 0.00 C ATOM 1082 CZ TYR A 576 -16.581 -4.956 -2.109 1.00 0.00 C ATOM 1083 OH TYR A 576 -17.841 -5.260 -1.693 1.00 0.00 O ATOM 0 H TYR A 576 -10.540 -2.331 -4.942 1.00 0.00 H new ATOM 0 HA TYR A 576 -13.448 -2.675 -4.740 1.00 0.00 H new ATOM 0 HB2 TYR A 576 -12.173 -4.857 -4.042 1.00 0.00 H new ATOM 0 HB3 TYR A 576 -11.900 -3.952 -2.566 1.00 0.00 H new ATOM 0 HD1 TYR A 576 -14.076 -2.685 -1.627 1.00 0.00 H new ATOM 0 HD2 TYR A 576 -14.151 -6.117 -4.214 1.00 0.00 H new ATOM 0 HE1 TYR A 576 -16.360 -3.228 -0.823 1.00 0.00 H new ATOM 0 HE2 TYR A 576 -16.476 -6.610 -3.502 1.00 0.00 H new ATOM 0 HH TYR A 576 -17.930 -5.051 -0.740 1.00 0.00 H new ATOM 1093 N GLY A 577 -12.894 -0.354 -3.912 1.00 0.00 N ATOM 1094 CA GLY A 577 -12.899 0.949 -3.266 1.00 0.00 C ATOM 1095 C GLY A 577 -11.619 1.700 -3.578 1.00 0.00 C ATOM 1096 O GLY A 577 -11.615 2.601 -4.419 1.00 0.00 O ATOM 0 H GLY A 577 -13.391 -0.356 -4.803 1.00 0.00 H new ATOM 0 HA2 GLY A 577 -13.759 1.527 -3.605 1.00 0.00 H new ATOM 0 HA3 GLY A 577 -13.003 0.827 -2.188 1.00 0.00 H new ATOM 1100 N VAL A 578 -10.535 1.314 -2.912 1.00 0.00 N ATOM 1101 CA VAL A 578 -9.177 1.616 -3.341 1.00 0.00 C ATOM 1102 C VAL A 578 -8.795 0.552 -4.367 1.00 0.00 C ATOM 1103 O VAL A 578 -9.242 -0.598 -4.298 1.00 0.00 O ATOM 1104 CB VAL A 578 -8.237 1.627 -2.115 1.00 0.00 C ATOM 1105 CG1 VAL A 578 -6.741 1.528 -2.436 1.00 0.00 C ATOM 1106 CG2 VAL A 578 -8.479 2.873 -1.266 1.00 0.00 C ATOM 0 H VAL A 578 -10.578 0.775 -2.047 1.00 0.00 H new ATOM 0 HA VAL A 578 -9.096 2.602 -3.798 1.00 0.00 H new ATOM 0 HB VAL A 578 -8.492 0.718 -1.569 1.00 0.00 H new ATOM 0 HG11 VAL A 578 -6.168 1.544 -1.509 1.00 0.00 H new ATOM 0 HG12 VAL A 578 -6.544 0.598 -2.968 1.00 0.00 H new ATOM 0 HG13 VAL A 578 -6.446 2.372 -3.059 1.00 0.00 H new ATOM 0 HG21 VAL A 578 -7.808 2.864 -0.407 1.00 0.00 H new ATOM 0 HG22 VAL A 578 -8.289 3.764 -1.865 1.00 0.00 H new ATOM 0 HG23 VAL A 578 -9.512 2.882 -0.919 1.00 0.00 H new ATOM 1116 N ARG A 579 -7.931 0.934 -5.302 1.00 0.00 N ATOM 1117 CA ARG A 579 -7.245 -0.007 -6.156 1.00 0.00 C ATOM 1118 C ARG A 579 -6.155 -0.668 -5.328 1.00 0.00 C ATOM 1119 O ARG A 579 -5.184 -0.014 -4.942 1.00 0.00 O ATOM 1120 CB ARG A 579 -6.680 0.728 -7.371 1.00 0.00 C ATOM 1121 CG ARG A 579 -6.399 -0.265 -8.502 1.00 0.00 C ATOM 1122 CD ARG A 579 -7.704 -0.716 -9.174 1.00 0.00 C ATOM 1123 NE ARG A 579 -7.546 -0.840 -10.623 1.00 0.00 N ATOM 1124 CZ ARG A 579 -7.397 0.177 -11.477 1.00 0.00 C ATOM 1125 NH1 ARG A 579 -7.351 1.434 -11.051 1.00 0.00 N ATOM 1126 NH2 ARG A 579 -7.280 -0.082 -12.769 1.00 0.00 N ATOM 0 H ARG A 579 -7.692 1.909 -5.483 1.00 0.00 H new ATOM 0 HA ARG A 579 -7.919 -0.776 -6.532 1.00 0.00 H new ATOM 0 HB2 ARG A 579 -7.387 1.486 -7.709 1.00 0.00 H new ATOM 0 HB3 ARG A 579 -5.762 1.248 -7.097 1.00 0.00 H new ATOM 0 HG2 ARG A 579 -5.745 0.196 -9.242 1.00 0.00 H new ATOM 0 HG3 ARG A 579 -5.871 -1.132 -8.106 1.00 0.00 H new ATOM 0 HD2 ARG A 579 -8.017 -1.674 -8.758 1.00 0.00 H new ATOM 0 HD3 ARG A 579 -8.495 0.001 -8.953 1.00 0.00 H new ATOM 0 HE ARG A 579 -7.550 -1.782 -11.014 1.00 0.00 H new ATOM 0 HH11 ARG A 579 -7.430 1.638 -10.055 1.00 0.00 H new ATOM 0 HH12 ARG A 579 -7.237 2.195 -11.720 1.00 0.00 H new ATOM 0 HH21 ARG A 579 -7.304 -1.046 -13.100 1.00 0.00 H new ATOM 0 HH22 ARG A 579 -7.166 0.683 -13.434 1.00 0.00 H new ATOM 1140 N PHE A 580 -6.315 -1.946 -5.033 1.00 0.00 N ATOM 1141 CA PHE A 580 -5.366 -2.758 -4.303 1.00 0.00 C ATOM 1142 C PHE A 580 -4.662 -3.735 -5.248 1.00 0.00 C ATOM 1143 O PHE A 580 -5.099 -3.953 -6.377 1.00 0.00 O ATOM 1144 CB PHE A 580 -6.112 -3.503 -3.194 1.00 0.00 C ATOM 1145 CG PHE A 580 -6.597 -2.647 -2.045 1.00 0.00 C ATOM 1146 CD1 PHE A 580 -5.673 -2.242 -1.078 1.00 0.00 C ATOM 1147 CD2 PHE A 580 -7.950 -2.294 -1.900 1.00 0.00 C ATOM 1148 CE1 PHE A 580 -6.084 -1.511 0.045 1.00 0.00 C ATOM 1149 CE2 PHE A 580 -8.369 -1.569 -0.766 1.00 0.00 C ATOM 1150 CZ PHE A 580 -7.431 -1.157 0.201 1.00 0.00 C ATOM 0 H PHE A 580 -7.148 -2.466 -5.309 1.00 0.00 H new ATOM 0 HA PHE A 580 -4.599 -2.125 -3.857 1.00 0.00 H new ATOM 0 HB2 PHE A 580 -6.971 -4.009 -3.635 1.00 0.00 H new ATOM 0 HB3 PHE A 580 -5.456 -4.277 -2.796 1.00 0.00 H new ATOM 0 HD1 PHE A 580 -4.630 -2.495 -1.197 1.00 0.00 H new ATOM 0 HD2 PHE A 580 -8.667 -2.578 -2.656 1.00 0.00 H new ATOM 0 HE1 PHE A 580 -5.361 -1.220 0.792 1.00 0.00 H new ATOM 0 HE2 PHE A 580 -9.414 -1.328 -0.638 1.00 0.00 H new ATOM 0 HZ PHE A 580 -7.747 -0.574 1.054 1.00 0.00 H new ATOM 1160 N PHE A 581 -3.603 -4.378 -4.761 1.00 0.00 N ATOM 1161 CA PHE A 581 -2.903 -5.483 -5.392 1.00 0.00 C ATOM 1162 C PHE A 581 -2.516 -6.441 -4.268 1.00 0.00 C ATOM 1163 O PHE A 581 -1.653 -6.116 -3.452 1.00 0.00 O ATOM 1164 CB PHE A 581 -1.683 -4.989 -6.178 1.00 0.00 C ATOM 1165 CG PHE A 581 -0.742 -6.102 -6.598 1.00 0.00 C ATOM 1166 CD1 PHE A 581 -1.151 -7.045 -7.557 1.00 0.00 C ATOM 1167 CD2 PHE A 581 0.525 -6.224 -5.997 1.00 0.00 C ATOM 1168 CE1 PHE A 581 -0.304 -8.110 -7.904 1.00 0.00 C ATOM 1169 CE2 PHE A 581 1.379 -7.281 -6.355 1.00 0.00 C ATOM 1170 CZ PHE A 581 0.952 -8.242 -7.286 1.00 0.00 C ATOM 0 H PHE A 581 -3.191 -4.123 -3.864 1.00 0.00 H new ATOM 0 HA PHE A 581 -3.533 -5.989 -6.123 1.00 0.00 H new ATOM 0 HB2 PHE A 581 -2.024 -4.458 -7.067 1.00 0.00 H new ATOM 0 HB3 PHE A 581 -1.134 -4.271 -5.568 1.00 0.00 H new ATOM 0 HD1 PHE A 581 -2.118 -6.950 -8.028 1.00 0.00 H new ATOM 0 HD2 PHE A 581 0.842 -5.503 -5.258 1.00 0.00 H new ATOM 0 HE1 PHE A 581 -0.618 -8.829 -8.647 1.00 0.00 H new ATOM 0 HE2 PHE A 581 2.362 -7.354 -5.915 1.00 0.00 H new ATOM 0 HZ PHE A 581 1.588 -9.081 -7.527 1.00 0.00 H new ATOM 1180 N PHE A 582 -3.215 -7.566 -4.164 1.00 0.00 N ATOM 1181 CA PHE A 582 -3.060 -8.565 -3.120 1.00 0.00 C ATOM 1182 C PHE A 582 -2.061 -9.622 -3.594 1.00 0.00 C ATOM 1183 O PHE A 582 -2.390 -10.457 -4.442 1.00 0.00 O ATOM 1184 CB PHE A 582 -4.443 -9.137 -2.751 1.00 0.00 C ATOM 1185 CG PHE A 582 -5.366 -8.232 -1.933 1.00 0.00 C ATOM 1186 CD1 PHE A 582 -5.022 -6.906 -1.592 1.00 0.00 C ATOM 1187 CD2 PHE A 582 -6.605 -8.738 -1.498 1.00 0.00 C ATOM 1188 CE1 PHE A 582 -5.896 -6.114 -0.828 1.00 0.00 C ATOM 1189 CE2 PHE A 582 -7.492 -7.935 -0.756 1.00 0.00 C ATOM 1190 CZ PHE A 582 -7.134 -6.620 -0.415 1.00 0.00 C ATOM 0 H PHE A 582 -3.938 -7.815 -4.839 1.00 0.00 H new ATOM 0 HA PHE A 582 -2.654 -8.131 -2.206 1.00 0.00 H new ATOM 0 HB2 PHE A 582 -4.958 -9.403 -3.674 1.00 0.00 H new ATOM 0 HB3 PHE A 582 -4.291 -10.061 -2.193 1.00 0.00 H new ATOM 0 HD1 PHE A 582 -4.078 -6.496 -1.921 1.00 0.00 H new ATOM 0 HD2 PHE A 582 -6.879 -9.755 -1.736 1.00 0.00 H new ATOM 0 HE1 PHE A 582 -5.611 -5.108 -0.558 1.00 0.00 H new ATOM 0 HE2 PHE A 582 -8.449 -8.330 -0.449 1.00 0.00 H new ATOM 0 HZ PHE A 582 -7.809 -6.004 0.161 1.00 0.00 H new ATOM 1200 N TYR A 583 -0.856 -9.612 -3.018 1.00 0.00 N ATOM 1201 CA TYR A 583 0.253 -10.535 -3.272 1.00 0.00 C ATOM 1202 C TYR A 583 0.495 -11.414 -2.042 1.00 0.00 C ATOM 1203 O TYR A 583 0.239 -10.984 -0.911 1.00 0.00 O ATOM 1204 CB TYR A 583 1.524 -9.747 -3.611 1.00 0.00 C ATOM 1205 CG TYR A 583 2.097 -8.946 -2.451 1.00 0.00 C ATOM 1206 CD1 TYR A 583 2.957 -9.566 -1.522 1.00 0.00 C ATOM 1207 CD2 TYR A 583 1.733 -7.598 -2.268 1.00 0.00 C ATOM 1208 CE1 TYR A 583 3.459 -8.853 -0.422 1.00 0.00 C ATOM 1209 CE2 TYR A 583 2.217 -6.883 -1.157 1.00 0.00 C ATOM 1210 CZ TYR A 583 3.081 -7.508 -0.231 1.00 0.00 C ATOM 1211 OH TYR A 583 3.520 -6.831 0.864 1.00 0.00 O ATOM 0 H TYR A 583 -0.613 -8.913 -2.316 1.00 0.00 H new ATOM 0 HA TYR A 583 -0.004 -11.173 -4.118 1.00 0.00 H new ATOM 0 HB2 TYR A 583 2.284 -10.443 -3.966 1.00 0.00 H new ATOM 0 HB3 TYR A 583 1.306 -9.066 -4.434 1.00 0.00 H new ATOM 0 HD1 TYR A 583 3.233 -10.601 -1.658 1.00 0.00 H new ATOM 0 HD2 TYR A 583 1.082 -7.113 -2.980 1.00 0.00 H new ATOM 0 HE1 TYR A 583 4.131 -9.332 0.274 1.00 0.00 H new ATOM 0 HE2 TYR A 583 1.927 -5.853 -1.012 1.00 0.00 H new ATOM 0 HH TYR A 583 4.393 -7.182 1.137 1.00 0.00 H new ATOM 1221 N THR A 584 0.957 -12.649 -2.235 1.00 0.00 N ATOM 1222 CA THR A 584 0.883 -13.640 -1.170 1.00 0.00 C ATOM 1223 C THR A 584 1.995 -13.439 -0.133 1.00 0.00 C ATOM 1224 O THR A 584 3.009 -12.782 -0.380 1.00 0.00 O ATOM 1225 CB THR A 584 0.888 -15.060 -1.768 1.00 0.00 C ATOM 1226 OG1 THR A 584 2.070 -15.300 -2.496 1.00 0.00 O ATOM 1227 CG2 THR A 584 -0.326 -15.342 -2.661 1.00 0.00 C ATOM 0 H THR A 584 1.378 -12.980 -3.103 1.00 0.00 H new ATOM 0 HA THR A 584 -0.057 -13.507 -0.635 1.00 0.00 H new ATOM 0 HB THR A 584 0.835 -15.739 -0.917 1.00 0.00 H new ATOM 0 HG1 THR A 584 2.049 -16.208 -2.864 1.00 0.00 H new ATOM 0 HG21 THR A 584 -0.263 -16.358 -3.051 1.00 0.00 H new ATOM 0 HG22 THR A 584 -1.240 -15.234 -2.077 1.00 0.00 H new ATOM 0 HG23 THR A 584 -0.339 -14.635 -3.491 1.00 0.00 H new ATOM 1235 N SER A 585 1.854 -14.099 1.016 1.00 0.00 N ATOM 1236 CA SER A 585 2.944 -14.396 1.934 1.00 0.00 C ATOM 1237 C SER A 585 4.134 -15.045 1.208 1.00 0.00 C ATOM 1238 O SER A 585 5.283 -14.804 1.576 1.00 0.00 O ATOM 1239 CB SER A 585 2.412 -15.294 3.070 1.00 0.00 C ATOM 1240 OG SER A 585 1.117 -15.833 2.799 1.00 0.00 O ATOM 0 H SER A 585 0.952 -14.450 1.339 1.00 0.00 H new ATOM 0 HA SER A 585 3.316 -13.465 2.361 1.00 0.00 H new ATOM 0 HB2 SER A 585 3.112 -16.113 3.236 1.00 0.00 H new ATOM 0 HB3 SER A 585 2.372 -14.716 3.993 1.00 0.00 H new ATOM 0 HG SER A 585 0.832 -16.394 3.551 1.00 0.00 H new ATOM 1246 N LYS A 586 3.870 -15.864 0.184 1.00 0.00 N ATOM 1247 CA LYS A 586 4.865 -16.694 -0.457 1.00 0.00 C ATOM 1248 C LYS A 586 5.631 -15.993 -1.573 1.00 0.00 C ATOM 1249 O LYS A 586 6.676 -16.514 -1.962 1.00 0.00 O ATOM 1250 CB LYS A 586 4.142 -17.952 -0.975 1.00 0.00 C ATOM 1251 CG LYS A 586 4.979 -19.222 -0.817 1.00 0.00 C ATOM 1252 CD LYS A 586 4.928 -19.856 0.583 1.00 0.00 C ATOM 1253 CE LYS A 586 5.591 -18.995 1.665 1.00 0.00 C ATOM 1254 NZ LYS A 586 5.707 -19.684 2.963 1.00 0.00 N ATOM 0 H LYS A 586 2.939 -15.962 -0.221 1.00 0.00 H new ATOM 0 HA LYS A 586 5.632 -16.949 0.275 1.00 0.00 H new ATOM 0 HB2 LYS A 586 3.202 -18.073 -0.437 1.00 0.00 H new ATOM 0 HB3 LYS A 586 3.892 -17.815 -2.027 1.00 0.00 H new ATOM 0 HG2 LYS A 586 4.640 -19.957 -1.546 1.00 0.00 H new ATOM 0 HG3 LYS A 586 6.016 -18.989 -1.058 1.00 0.00 H new ATOM 0 HD2 LYS A 586 3.888 -20.033 0.856 1.00 0.00 H new ATOM 0 HD3 LYS A 586 5.419 -20.829 0.552 1.00 0.00 H new ATOM 0 HE2 LYS A 586 6.584 -18.700 1.327 1.00 0.00 H new ATOM 0 HE3 LYS A 586 5.014 -18.080 1.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 586 6.162 -19.052 3.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 586 4.759 -19.943 3.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 586 6.281 -20.544 2.850 1.00 0.00 H new ATOM 1268 N GLU A 587 5.151 -14.864 -2.099 1.00 0.00 N ATOM 1269 CA GLU A 587 5.831 -14.218 -3.211 1.00 0.00 C ATOM 1270 C GLU A 587 6.935 -13.284 -2.685 1.00 0.00 C ATOM 1271 O GLU A 587 6.619 -12.374 -1.911 1.00 0.00 O ATOM 1272 CB GLU A 587 4.808 -13.516 -4.100 1.00 0.00 C ATOM 1273 CG GLU A 587 5.448 -13.120 -5.434 1.00 0.00 C ATOM 1274 CD GLU A 587 4.388 -12.873 -6.514 1.00 0.00 C ATOM 1275 OE1 GLU A 587 3.491 -12.022 -6.336 1.00 0.00 O ATOM 1276 OE2 GLU A 587 4.393 -13.602 -7.531 1.00 0.00 O ATOM 0 H GLU A 587 4.308 -14.389 -1.776 1.00 0.00 H new ATOM 0 HA GLU A 587 6.331 -14.959 -3.834 1.00 0.00 H new ATOM 0 HB2 GLU A 587 3.958 -14.174 -4.278 1.00 0.00 H new ATOM 0 HB3 GLU A 587 4.425 -12.629 -3.595 1.00 0.00 H new ATOM 0 HG2 GLU A 587 6.047 -12.220 -5.298 1.00 0.00 H new ATOM 0 HG3 GLU A 587 6.126 -13.908 -5.762 1.00 0.00 H new ATOM 1283 N PRO A 588 8.220 -13.489 -3.040 1.00 0.00 N ATOM 1284 CA PRO A 588 9.329 -12.663 -2.572 1.00 0.00 C ATOM 1285 C PRO A 588 9.178 -11.212 -2.986 1.00 0.00 C ATOM 1286 O PRO A 588 8.498 -10.852 -3.947 1.00 0.00 O ATOM 1287 CB PRO A 588 10.620 -13.228 -3.161 1.00 0.00 C ATOM 1288 CG PRO A 588 10.228 -14.586 -3.705 1.00 0.00 C ATOM 1289 CD PRO A 588 8.718 -14.523 -3.925 1.00 0.00 C ATOM 0 HA PRO A 588 9.345 -12.686 -1.482 1.00 0.00 H new ATOM 0 HB2 PRO A 588 11.012 -12.584 -3.948 1.00 0.00 H new ATOM 0 HB3 PRO A 588 11.398 -13.314 -2.402 1.00 0.00 H new ATOM 0 HG2 PRO A 588 10.751 -14.800 -4.637 1.00 0.00 H new ATOM 0 HG3 PRO A 588 10.489 -15.379 -3.004 1.00 0.00 H new ATOM 0 HD2 PRO A 588 8.486 -14.290 -4.964 1.00 0.00 H new ATOM 0 HD3 PRO A 588 8.252 -15.483 -3.702 1.00 0.00 H new ATOM 1297 N VAL A 589 9.927 -10.375 -2.293 1.00 0.00 N ATOM 1298 CA VAL A 589 9.827 -8.929 -2.431 1.00 0.00 C ATOM 1299 C VAL A 589 10.322 -8.528 -3.826 1.00 0.00 C ATOM 1300 O VAL A 589 9.779 -7.617 -4.442 1.00 0.00 O ATOM 1301 CB VAL A 589 10.662 -8.242 -1.319 1.00 0.00 C ATOM 1302 CG1 VAL A 589 10.438 -6.724 -1.261 1.00 0.00 C ATOM 1303 CG2 VAL A 589 10.360 -8.781 0.086 1.00 0.00 C ATOM 0 H VAL A 589 10.626 -10.678 -1.615 1.00 0.00 H new ATOM 0 HA VAL A 589 8.791 -8.607 -2.322 1.00 0.00 H new ATOM 0 HB VAL A 589 11.692 -8.469 -1.595 1.00 0.00 H new ATOM 0 HG11 VAL A 589 11.047 -6.296 -0.465 1.00 0.00 H new ATOM 0 HG12 VAL A 589 10.721 -6.278 -2.214 1.00 0.00 H new ATOM 0 HG13 VAL A 589 9.386 -6.519 -1.063 1.00 0.00 H new ATOM 0 HG21 VAL A 589 10.977 -8.258 0.817 1.00 0.00 H new ATOM 0 HG22 VAL A 589 9.307 -8.620 0.319 1.00 0.00 H new ATOM 0 HG23 VAL A 589 10.580 -9.848 0.122 1.00 0.00 H new ATOM 1313 N ALA A 590 11.322 -9.216 -4.371 1.00 0.00 N ATOM 1314 CA ALA A 590 11.778 -8.945 -5.726 1.00 0.00 C ATOM 1315 C ALA A 590 10.759 -9.432 -6.767 1.00 0.00 C ATOM 1316 O ALA A 590 10.634 -8.814 -7.826 1.00 0.00 O ATOM 1317 CB ALA A 590 13.141 -9.592 -5.939 1.00 0.00 C ATOM 0 H ALA A 590 11.829 -9.962 -3.895 1.00 0.00 H new ATOM 0 HA ALA A 590 11.874 -7.867 -5.858 1.00 0.00 H new ATOM 0 HB1 ALA A 590 13.485 -9.390 -6.954 1.00 0.00 H new ATOM 0 HB2 ALA A 590 13.855 -9.180 -5.225 1.00 0.00 H new ATOM 0 HB3 ALA A 590 13.060 -10.669 -5.791 1.00 0.00 H new ATOM 1323 N SER A 591 10.019 -10.515 -6.505 1.00 0.00 N ATOM 1324 CA SER A 591 9.024 -11.049 -7.401 1.00 0.00 C ATOM 1325 C SER A 591 7.810 -10.132 -7.460 1.00 0.00 C ATOM 1326 O SER A 591 7.381 -9.807 -8.569 1.00 0.00 O ATOM 1327 CB SER A 591 8.628 -12.425 -6.896 1.00 0.00 C ATOM 1328 OG SER A 591 9.707 -13.332 -6.966 1.00 0.00 O ATOM 0 H SER A 591 10.108 -11.047 -5.639 1.00 0.00 H new ATOM 0 HA SER A 591 9.430 -11.122 -8.410 1.00 0.00 H new ATOM 0 HB2 SER A 591 8.281 -12.350 -5.865 1.00 0.00 H new ATOM 0 HB3 SER A 591 7.794 -12.804 -7.486 1.00 0.00 H new ATOM 0 HG SER A 591 9.365 -14.250 -6.945 1.00 0.00 H new ATOM 1334 N ILE A 592 7.257 -9.705 -6.315 1.00 0.00 N ATOM 1335 CA ILE A 592 6.129 -8.783 -6.334 1.00 0.00 C ATOM 1336 C ILE A 592 6.570 -7.493 -7.032 1.00 0.00 C ATOM 1337 O ILE A 592 5.832 -6.985 -7.865 1.00 0.00 O ATOM 1338 CB ILE A 592 5.536 -8.549 -4.924 1.00 0.00 C ATOM 1339 CG1 ILE A 592 6.445 -7.745 -3.990 1.00 0.00 C ATOM 1340 CG2 ILE A 592 5.230 -9.861 -4.204 1.00 0.00 C ATOM 1341 CD1 ILE A 592 6.087 -6.256 -3.971 1.00 0.00 C ATOM 0 H ILE A 592 7.570 -9.981 -5.384 1.00 0.00 H new ATOM 0 HA ILE A 592 5.307 -9.220 -6.901 1.00 0.00 H new ATOM 0 HB ILE A 592 4.627 -7.981 -5.123 1.00 0.00 H new ATOM 0 HG12 ILE A 592 6.371 -8.147 -2.980 1.00 0.00 H new ATOM 0 HG13 ILE A 592 7.482 -7.863 -4.305 1.00 0.00 H new ATOM 0 HG21 ILE A 592 4.816 -9.647 -3.219 1.00 0.00 H new ATOM 0 HG22 ILE A 592 4.508 -10.435 -4.785 1.00 0.00 H new ATOM 0 HG23 ILE A 592 6.148 -10.438 -4.094 1.00 0.00 H new ATOM 0 HD11 ILE A 592 6.760 -5.729 -3.294 1.00 0.00 H new ATOM 0 HD12 ILE A 592 6.187 -5.845 -4.976 1.00 0.00 H new ATOM 0 HD13 ILE A 592 5.059 -6.133 -3.630 1.00 0.00 H new ATOM 1353 N ILE A 593 7.789 -6.993 -6.781 1.00 0.00 N ATOM 1354 CA ILE A 593 8.289 -5.811 -7.465 1.00 0.00 C ATOM 1355 C ILE A 593 8.280 -6.045 -8.970 1.00 0.00 C ATOM 1356 O ILE A 593 7.669 -5.245 -9.672 1.00 0.00 O ATOM 1357 CB ILE A 593 9.646 -5.375 -6.874 1.00 0.00 C ATOM 1358 CG1 ILE A 593 9.353 -4.665 -5.529 1.00 0.00 C ATOM 1359 CG2 ILE A 593 10.384 -4.445 -7.843 1.00 0.00 C ATOM 1360 CD1 ILE A 593 10.599 -4.262 -4.737 1.00 0.00 C ATOM 0 H ILE A 593 8.441 -7.396 -6.107 1.00 0.00 H new ATOM 0 HA ILE A 593 7.629 -4.960 -7.297 1.00 0.00 H new ATOM 0 HB ILE A 593 10.293 -6.237 -6.712 1.00 0.00 H new ATOM 0 HG12 ILE A 593 8.759 -3.772 -5.726 1.00 0.00 H new ATOM 0 HG13 ILE A 593 8.743 -5.324 -4.911 1.00 0.00 H new ATOM 0 HG21 ILE A 593 11.338 -4.149 -7.407 1.00 0.00 H new ATOM 0 HG22 ILE A 593 10.561 -4.966 -8.784 1.00 0.00 H new ATOM 0 HG23 ILE A 593 9.779 -3.558 -8.028 1.00 0.00 H new ATOM 0 HD11 ILE A 593 10.299 -3.772 -3.811 1.00 0.00 H new ATOM 0 HD12 ILE A 593 11.185 -5.151 -4.504 1.00 0.00 H new ATOM 0 HD13 ILE A 593 11.202 -3.576 -5.332 1.00 0.00 H new ATOM 1372 N THR A 594 8.901 -7.113 -9.475 1.00 0.00 N ATOM 1373 CA THR A 594 8.867 -7.478 -10.889 1.00 0.00 C ATOM 1374 C THR A 594 7.444 -7.435 -11.452 1.00 0.00 C ATOM 1375 O THR A 594 7.235 -6.932 -12.556 1.00 0.00 O ATOM 1376 CB THR A 594 9.530 -8.854 -11.054 1.00 0.00 C ATOM 1377 OG1 THR A 594 10.936 -8.687 -11.079 1.00 0.00 O ATOM 1378 CG2 THR A 594 9.057 -9.623 -12.290 1.00 0.00 C ATOM 0 H THR A 594 9.449 -7.756 -8.904 1.00 0.00 H new ATOM 0 HA THR A 594 9.428 -6.748 -11.472 1.00 0.00 H new ATOM 0 HB THR A 594 9.230 -9.462 -10.200 1.00 0.00 H new ATOM 0 HG1 THR A 594 11.367 -9.561 -11.182 1.00 0.00 H new ATOM 0 HG21 THR A 594 9.569 -10.584 -12.339 1.00 0.00 H new ATOM 0 HG22 THR A 594 7.981 -9.788 -12.226 1.00 0.00 H new ATOM 0 HG23 THR A 594 9.283 -9.046 -13.186 1.00 0.00 H new ATOM 1386 N LYS A 595 6.467 -7.924 -10.697 1.00 0.00 N ATOM 1387 CA LYS A 595 5.070 -7.882 -11.099 1.00 0.00 C ATOM 1388 C LYS A 595 4.661 -6.431 -11.249 1.00 0.00 C ATOM 1389 O LYS A 595 4.310 -6.056 -12.357 1.00 0.00 O ATOM 1390 CB LYS A 595 4.192 -8.683 -10.144 1.00 0.00 C ATOM 1391 CG LYS A 595 2.703 -8.589 -10.526 1.00 0.00 C ATOM 1392 CD LYS A 595 2.106 -9.870 -11.107 1.00 0.00 C ATOM 1393 CE LYS A 595 2.310 -9.935 -12.624 1.00 0.00 C ATOM 1394 NZ LYS A 595 1.508 -11.016 -13.222 1.00 0.00 N ATOM 0 H LYS A 595 6.623 -8.361 -9.789 1.00 0.00 H new ATOM 0 HA LYS A 595 4.932 -8.367 -12.065 1.00 0.00 H new ATOM 0 HB2 LYS A 595 4.505 -9.727 -10.151 1.00 0.00 H new ATOM 0 HB3 LYS A 595 4.331 -8.316 -9.127 1.00 0.00 H new ATOM 0 HG2 LYS A 595 2.133 -8.309 -9.640 1.00 0.00 H new ATOM 0 HG3 LYS A 595 2.579 -7.786 -11.252 1.00 0.00 H new ATOM 0 HD2 LYS A 595 2.570 -10.737 -10.637 1.00 0.00 H new ATOM 0 HD3 LYS A 595 1.041 -9.915 -10.878 1.00 0.00 H new ATOM 0 HE2 LYS A 595 2.032 -8.981 -13.072 1.00 0.00 H new ATOM 0 HE3 LYS A 595 3.365 -10.096 -12.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 595 1.665 -11.037 -14.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 595 1.792 -11.928 -12.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 595 0.500 -10.848 -13.030 1.00 0.00 H new ATOM 1408 N LEU A 596 4.785 -5.609 -10.199 1.00 0.00 N ATOM 1409 CA LEU A 596 4.447 -4.179 -10.188 1.00 0.00 C ATOM 1410 C LEU A 596 5.082 -3.389 -11.340 1.00 0.00 C ATOM 1411 O LEU A 596 4.586 -2.319 -11.690 1.00 0.00 O ATOM 1412 CB LEU A 596 4.882 -3.537 -8.861 1.00 0.00 C ATOM 1413 CG LEU A 596 4.226 -4.092 -7.586 1.00 0.00 C ATOM 1414 CD1 LEU A 596 4.844 -3.419 -6.355 1.00 0.00 C ATOM 1415 CD2 LEU A 596 2.717 -3.894 -7.600 1.00 0.00 C ATOM 0 H LEU A 596 5.137 -5.934 -9.299 1.00 0.00 H new ATOM 0 HA LEU A 596 3.365 -4.132 -10.311 1.00 0.00 H new ATOM 0 HB2 LEU A 596 5.962 -3.648 -8.766 1.00 0.00 H new ATOM 0 HB3 LEU A 596 4.675 -2.468 -8.914 1.00 0.00 H new ATOM 0 HG LEU A 596 4.413 -5.165 -7.545 1.00 0.00 H new ATOM 0 HD11 LEU A 596 4.378 -3.814 -5.452 1.00 0.00 H new ATOM 0 HD12 LEU A 596 5.915 -3.621 -6.329 1.00 0.00 H new ATOM 0 HD13 LEU A 596 4.679 -2.343 -6.408 1.00 0.00 H new ATOM 0 HD21 LEU A 596 2.288 -4.299 -6.683 1.00 0.00 H new ATOM 0 HD22 LEU A 596 2.490 -2.830 -7.668 1.00 0.00 H new ATOM 0 HD23 LEU A 596 2.290 -4.411 -8.459 1.00 0.00 H new ATOM 1427 N ASN A 597 6.148 -3.907 -11.956 1.00 0.00 N ATOM 1428 CA ASN A 597 6.747 -3.324 -13.160 1.00 0.00 C ATOM 1429 C ASN A 597 5.751 -3.262 -14.325 1.00 0.00 C ATOM 1430 O ASN A 597 5.889 -2.381 -15.175 1.00 0.00 O ATOM 1431 CB ASN A 597 7.949 -4.112 -13.728 1.00 0.00 C ATOM 1432 CG ASN A 597 9.218 -4.324 -12.910 1.00 0.00 C ATOM 1433 OD1 ASN A 597 9.194 -4.187 -11.600 1.00 0.00 O flip ATOM 1434 ND2 ASN A 597 10.247 -4.712 -13.458 1.00 0.00 N flip ATOM 0 H ASN A 597 6.623 -4.749 -11.631 1.00 0.00 H new ATOM 0 HA ASN A 597 7.065 -2.341 -12.814 1.00 0.00 H new ATOM 0 HB2 ASN A 597 7.580 -5.100 -14.002 1.00 0.00 H new ATOM 0 HB3 ASN A 597 8.246 -3.615 -14.652 1.00 0.00 H new ATOM 0 HD21 ASN A 597 10.275 -4.821 -14.472 1.00 0.00 H new ATOM 0 HD22 ASN A 597 11.073 -4.925 -12.899 1.00 0.00 H new ATOM 1441 N SER A 598 4.796 -4.194 -14.426 1.00 0.00 N ATOM 1442 CA SER A 598 3.921 -4.311 -15.578 1.00 0.00 C ATOM 1443 C SER A 598 2.838 -3.234 -15.452 1.00 0.00 C ATOM 1444 O SER A 598 2.264 -2.805 -16.446 1.00 0.00 O ATOM 1445 CB SER A 598 3.310 -5.712 -15.529 1.00 0.00 C ATOM 1446 OG SER A 598 3.917 -6.594 -16.449 1.00 0.00 O ATOM 0 H SER A 598 4.615 -4.888 -13.701 1.00 0.00 H new ATOM 0 HA SER A 598 4.445 -4.173 -16.524 1.00 0.00 H new ATOM 0 HB2 SER A 598 3.412 -6.115 -14.521 1.00 0.00 H new ATOM 0 HB3 SER A 598 2.243 -5.648 -15.741 1.00 0.00 H new ATOM 0 HG SER A 598 3.497 -7.477 -16.382 1.00 0.00 H new ATOM 1452 N LEU A 599 2.568 -2.824 -14.213 1.00 0.00 N ATOM 1453 CA LEU A 599 1.495 -1.997 -13.753 1.00 0.00 C ATOM 1454 C LEU A 599 1.997 -0.569 -13.848 1.00 0.00 C ATOM 1455 O LEU A 599 1.333 0.265 -14.449 1.00 0.00 O ATOM 1456 CB LEU A 599 1.162 -2.368 -12.299 1.00 0.00 C ATOM 1457 CG LEU A 599 0.599 -3.780 -12.131 1.00 0.00 C ATOM 1458 CD1 LEU A 599 1.488 -4.899 -12.580 1.00 0.00 C ATOM 1459 CD2 LEU A 599 0.193 -4.014 -10.679 1.00 0.00 C ATOM 0 H LEU A 599 3.170 -3.103 -13.439 1.00 0.00 H new ATOM 0 HA LEU A 599 0.587 -2.125 -14.343 1.00 0.00 H new ATOM 0 HB2 LEU A 599 2.064 -2.273 -11.695 1.00 0.00 H new ATOM 0 HB3 LEU A 599 0.440 -1.651 -11.908 1.00 0.00 H new ATOM 0 HG LEU A 599 -0.260 -3.808 -12.801 1.00 0.00 H new ATOM 0 HD11 LEU A 599 0.986 -5.852 -12.413 1.00 0.00 H new ATOM 0 HD12 LEU A 599 1.708 -4.785 -13.642 1.00 0.00 H new ATOM 0 HD13 LEU A 599 2.418 -4.875 -12.012 1.00 0.00 H new ATOM 0 HD21 LEU A 599 -0.206 -5.022 -10.571 1.00 0.00 H new ATOM 0 HD22 LEU A 599 1.064 -3.898 -10.034 1.00 0.00 H new ATOM 0 HD23 LEU A 599 -0.569 -3.289 -10.393 1.00 0.00 H new ATOM 1471 N ASN A 600 3.207 -0.321 -13.307 1.00 0.00 N ATOM 1472 CA ASN A 600 3.952 0.944 -13.356 1.00 0.00 C ATOM 1473 C ASN A 600 3.085 2.145 -12.968 1.00 0.00 C ATOM 1474 O ASN A 600 3.334 3.279 -13.382 1.00 0.00 O ATOM 1475 CB ASN A 600 4.748 1.096 -14.671 1.00 0.00 C ATOM 1476 CG ASN A 600 3.940 0.717 -15.902 1.00 0.00 C ATOM 1477 OD1 ASN A 600 3.093 1.470 -16.364 1.00 0.00 O ATOM 1478 ND2 ASN A 600 4.122 -0.494 -16.404 1.00 0.00 N ATOM 0 H ASN A 600 3.716 -1.042 -12.796 1.00 0.00 H new ATOM 0 HA ASN A 600 4.718 0.914 -12.581 1.00 0.00 H new ATOM 0 HB2 ASN A 600 5.085 2.128 -14.768 1.00 0.00 H new ATOM 0 HB3 ASN A 600 5.641 0.472 -14.623 1.00 0.00 H new ATOM 0 HD21 ASN A 600 3.552 -0.812 -17.188 1.00 0.00 H new ATOM 0 HD22 ASN A 600 4.832 -1.109 -16.007 1.00 0.00 H new ATOM 1485 N GLU A 601 2.099 1.892 -12.106 1.00 0.00 N ATOM 1486 CA GLU A 601 1.188 2.897 -11.597 1.00 0.00 C ATOM 1487 C GLU A 601 1.869 3.661 -10.459 1.00 0.00 C ATOM 1488 O GLU A 601 2.742 3.090 -9.791 1.00 0.00 O ATOM 1489 CB GLU A 601 -0.120 2.276 -11.071 1.00 0.00 C ATOM 1490 CG GLU A 601 -0.623 1.098 -11.906 1.00 0.00 C ATOM 1491 CD GLU A 601 -2.130 0.840 -11.815 1.00 0.00 C ATOM 1492 OE1 GLU A 601 -2.829 1.459 -10.980 1.00 0.00 O ATOM 1493 OE2 GLU A 601 -2.642 0.051 -12.647 1.00 0.00 O ATOM 0 H GLU A 601 1.914 0.958 -11.739 1.00 0.00 H new ATOM 0 HA GLU A 601 0.936 3.567 -12.419 1.00 0.00 H new ATOM 0 HB2 GLU A 601 0.034 1.942 -10.045 1.00 0.00 H new ATOM 0 HB3 GLU A 601 -0.891 3.046 -11.044 1.00 0.00 H new ATOM 0 HG2 GLU A 601 -0.362 1.273 -12.950 1.00 0.00 H new ATOM 0 HG3 GLU A 601 -0.095 0.197 -11.592 1.00 0.00 H new ATOM 1500 N PRO A 602 1.428 4.896 -10.173 1.00 0.00 N ATOM 1501 CA PRO A 602 1.783 5.603 -8.956 1.00 0.00 C ATOM 1502 C PRO A 602 1.211 4.849 -7.752 1.00 0.00 C ATOM 1503 O PRO A 602 -0.010 4.701 -7.636 1.00 0.00 O ATOM 1504 CB PRO A 602 1.164 7.000 -9.075 1.00 0.00 C ATOM 1505 CG PRO A 602 0.386 7.028 -10.393 1.00 0.00 C ATOM 1506 CD PRO A 602 0.384 5.593 -10.902 1.00 0.00 C ATOM 0 HA PRO A 602 2.862 5.675 -8.819 1.00 0.00 H new ATOM 0 HB2 PRO A 602 0.504 7.203 -8.232 1.00 0.00 H new ATOM 0 HB3 PRO A 602 1.938 7.768 -9.066 1.00 0.00 H new ATOM 0 HG2 PRO A 602 -0.631 7.390 -10.240 1.00 0.00 H new ATOM 0 HG3 PRO A 602 0.858 7.698 -11.112 1.00 0.00 H new ATOM 0 HD2 PRO A 602 -0.585 5.123 -10.735 1.00 0.00 H new ATOM 0 HD3 PRO A 602 0.573 5.562 -11.975 1.00 0.00 H new ATOM 1514 N LEU A 603 2.074 4.377 -6.850 1.00 0.00 N ATOM 1515 CA LEU A 603 1.634 3.674 -5.652 1.00 0.00 C ATOM 1516 C LEU A 603 1.646 4.592 -4.432 1.00 0.00 C ATOM 1517 O LEU A 603 2.372 5.596 -4.388 1.00 0.00 O ATOM 1518 CB LEU A 603 2.549 2.481 -5.324 1.00 0.00 C ATOM 1519 CG LEU A 603 2.851 1.498 -6.460 1.00 0.00 C ATOM 1520 CD1 LEU A 603 3.734 0.390 -5.888 1.00 0.00 C ATOM 1521 CD2 LEU A 603 1.589 0.874 -7.046 1.00 0.00 C ATOM 0 H LEU A 603 3.086 4.472 -6.931 1.00 0.00 H new ATOM 0 HA LEU A 603 0.622 3.329 -5.865 1.00 0.00 H new ATOM 0 HB2 LEU A 603 3.497 2.873 -4.956 1.00 0.00 H new ATOM 0 HB3 LEU A 603 2.096 1.922 -4.505 1.00 0.00 H new ATOM 0 HG LEU A 603 3.344 2.041 -7.266 1.00 0.00 H new ATOM 0 HD11 LEU A 603 3.969 -0.330 -6.672 1.00 0.00 H new ATOM 0 HD12 LEU A 603 4.658 0.823 -5.504 1.00 0.00 H new ATOM 0 HD13 LEU A 603 3.206 -0.115 -5.079 1.00 0.00 H new ATOM 0 HD21 LEU A 603 1.861 0.186 -7.847 1.00 0.00 H new ATOM 0 HD22 LEU A 603 1.056 0.330 -6.266 1.00 0.00 H new ATOM 0 HD23 LEU A 603 0.946 1.659 -7.445 1.00 0.00 H new ATOM 1533 N VAL A 604 0.959 4.155 -3.380 1.00 0.00 N ATOM 1534 CA VAL A 604 1.173 4.587 -2.009 1.00 0.00 C ATOM 1535 C VAL A 604 1.098 3.327 -1.145 1.00 0.00 C ATOM 1536 O VAL A 604 0.146 2.552 -1.248 1.00 0.00 O ATOM 1537 CB VAL A 604 0.175 5.707 -1.634 1.00 0.00 C ATOM 1538 CG1 VAL A 604 -1.287 5.370 -1.938 1.00 0.00 C ATOM 1539 CG2 VAL A 604 0.271 6.086 -0.154 1.00 0.00 C ATOM 0 H VAL A 604 0.212 3.466 -3.466 1.00 0.00 H new ATOM 0 HA VAL A 604 2.149 5.047 -1.851 1.00 0.00 H new ATOM 0 HB VAL A 604 0.472 6.544 -2.266 1.00 0.00 H new ATOM 0 HG11 VAL A 604 -1.922 6.207 -1.646 1.00 0.00 H new ATOM 0 HG12 VAL A 604 -1.403 5.182 -3.005 1.00 0.00 H new ATOM 0 HG13 VAL A 604 -1.579 4.481 -1.379 1.00 0.00 H new ATOM 0 HG21 VAL A 604 -0.447 6.876 0.067 1.00 0.00 H new ATOM 0 HG22 VAL A 604 0.050 5.213 0.460 1.00 0.00 H new ATOM 0 HG23 VAL A 604 1.278 6.439 0.067 1.00 0.00 H new ATOM 1549 N THR A 605 2.119 3.071 -0.327 1.00 0.00 N ATOM 1550 CA THR A 605 2.159 1.896 0.538 1.00 0.00 C ATOM 1551 C THR A 605 3.099 2.096 1.734 1.00 0.00 C ATOM 1552 O THR A 605 3.682 3.160 1.917 1.00 0.00 O ATOM 1553 CB THR A 605 2.481 0.659 -0.319 1.00 0.00 C ATOM 1554 OG1 THR A 605 2.371 -0.533 0.430 1.00 0.00 O ATOM 1555 CG2 THR A 605 3.832 0.741 -1.031 1.00 0.00 C ATOM 0 H THR A 605 2.939 3.672 -0.247 1.00 0.00 H new ATOM 0 HA THR A 605 1.182 1.734 0.993 1.00 0.00 H new ATOM 0 HB THR A 605 1.727 0.642 -1.106 1.00 0.00 H new ATOM 0 HG1 THR A 605 1.657 -1.090 0.056 1.00 0.00 H new ATOM 0 HG21 THR A 605 3.991 -0.165 -1.616 1.00 0.00 H new ATOM 0 HG22 THR A 605 3.842 1.607 -1.693 1.00 0.00 H new ATOM 0 HG23 THR A 605 4.627 0.840 -0.292 1.00 0.00 H new ATOM 1563 N MET A 606 3.204 1.091 2.595 1.00 0.00 N ATOM 1564 CA MET A 606 4.247 0.964 3.612 1.00 0.00 C ATOM 1565 C MET A 606 5.446 0.252 2.952 1.00 0.00 C ATOM 1566 O MET A 606 5.309 -0.165 1.802 1.00 0.00 O ATOM 1567 CB MET A 606 3.643 0.209 4.806 1.00 0.00 C ATOM 1568 CG MET A 606 2.460 1.008 5.363 1.00 0.00 C ATOM 1569 SD MET A 606 1.600 0.272 6.775 1.00 0.00 S ATOM 1570 CE MET A 606 0.725 -1.036 5.890 1.00 0.00 C ATOM 0 H MET A 606 2.544 0.314 2.607 1.00 0.00 H new ATOM 0 HA MET A 606 4.610 1.918 3.993 1.00 0.00 H new ATOM 0 HB2 MET A 606 3.313 -0.782 4.495 1.00 0.00 H new ATOM 0 HB3 MET A 606 4.397 0.066 5.580 1.00 0.00 H new ATOM 0 HG2 MET A 606 2.819 1.995 5.656 1.00 0.00 H new ATOM 0 HG3 MET A 606 1.738 1.157 4.560 1.00 0.00 H new ATOM 0 HE1 MET A 606 -0.272 -1.157 6.313 1.00 0.00 H new ATOM 0 HE2 MET A 606 0.642 -0.770 4.836 1.00 0.00 H new ATOM 0 HE3 MET A 606 1.276 -1.972 5.986 1.00 0.00 H new ATOM 1580 N PRO A 607 6.621 0.094 3.593 1.00 0.00 N ATOM 1581 CA PRO A 607 7.803 -0.485 2.938 1.00 0.00 C ATOM 1582 C PRO A 607 7.749 -2.012 2.706 1.00 0.00 C ATOM 1583 O PRO A 607 8.740 -2.710 2.886 1.00 0.00 O ATOM 1584 CB PRO A 607 8.989 -0.050 3.810 1.00 0.00 C ATOM 1585 CG PRO A 607 8.441 0.452 5.132 1.00 0.00 C ATOM 1586 CD PRO A 607 6.956 0.691 4.879 1.00 0.00 C ATOM 0 HA PRO A 607 7.882 -0.117 1.915 1.00 0.00 H new ATOM 0 HB2 PRO A 607 9.669 -0.886 3.973 1.00 0.00 H new ATOM 0 HB3 PRO A 607 9.560 0.734 3.312 1.00 0.00 H new ATOM 0 HG2 PRO A 607 8.593 -0.280 5.926 1.00 0.00 H new ATOM 0 HG3 PRO A 607 8.941 1.369 5.444 1.00 0.00 H new ATOM 0 HD2 PRO A 607 6.357 0.247 5.674 1.00 0.00 H new ATOM 0 HD3 PRO A 607 6.737 1.759 4.873 1.00 0.00 H new ATOM 1594 N ILE A 608 6.611 -2.531 2.240 1.00 0.00 N ATOM 1595 CA ILE A 608 6.342 -3.843 1.662 1.00 0.00 C ATOM 1596 C ILE A 608 7.170 -4.974 2.265 1.00 0.00 C ATOM 1597 O ILE A 608 6.698 -5.641 3.189 1.00 0.00 O ATOM 1598 CB ILE A 608 6.339 -3.718 0.116 1.00 0.00 C ATOM 1599 CG1 ILE A 608 5.076 -2.959 -0.362 1.00 0.00 C ATOM 1600 CG2 ILE A 608 6.421 -5.041 -0.658 1.00 0.00 C ATOM 1601 CD1 ILE A 608 3.780 -3.767 -0.257 1.00 0.00 C ATOM 0 H ILE A 608 5.758 -1.973 2.263 1.00 0.00 H new ATOM 0 HA ILE A 608 5.342 -4.172 1.945 1.00 0.00 H new ATOM 0 HB ILE A 608 7.256 -3.172 -0.106 1.00 0.00 H new ATOM 0 HG12 ILE A 608 4.970 -2.047 0.225 1.00 0.00 H new ATOM 0 HG13 ILE A 608 5.219 -2.656 -1.399 1.00 0.00 H new ATOM 0 HG21 ILE A 608 6.412 -4.837 -1.729 1.00 0.00 H new ATOM 0 HG22 ILE A 608 7.343 -5.560 -0.395 1.00 0.00 H new ATOM 0 HG23 ILE A 608 5.567 -5.667 -0.400 1.00 0.00 H new ATOM 0 HD11 ILE A 608 2.945 -3.163 -0.611 1.00 0.00 H new ATOM 0 HD12 ILE A 608 3.862 -4.667 -0.867 1.00 0.00 H new ATOM 0 HD13 ILE A 608 3.609 -4.048 0.782 1.00 0.00 H new ATOM 1613 N GLY A 609 8.360 -5.257 1.752 1.00 0.00 N ATOM 1614 CA GLY A 609 9.270 -6.226 2.325 1.00 0.00 C ATOM 1615 C GLY A 609 10.036 -5.575 3.469 1.00 0.00 C ATOM 1616 O GLY A 609 11.231 -5.393 3.351 1.00 0.00 O ATOM 0 H GLY A 609 8.722 -4.808 0.910 1.00 0.00 H new ATOM 0 HA2 GLY A 609 8.717 -7.092 2.688 1.00 0.00 H new ATOM 0 HA3 GLY A 609 9.963 -6.586 1.565 1.00 0.00 H new ATOM 1620 N TYR A 610 9.376 -5.253 4.575 1.00 0.00 N ATOM 1621 CA TYR A 610 9.923 -4.722 5.813 1.00 0.00 C ATOM 1622 C TYR A 610 9.671 -5.651 7.009 1.00 0.00 C ATOM 1623 O TYR A 610 10.632 -5.967 7.701 1.00 0.00 O ATOM 1624 CB TYR A 610 9.375 -3.301 5.999 1.00 0.00 C ATOM 1625 CG TYR A 610 9.578 -2.661 7.353 1.00 0.00 C ATOM 1626 CD1 TYR A 610 10.843 -2.653 7.965 1.00 0.00 C ATOM 1627 CD2 TYR A 610 8.483 -2.067 8.000 1.00 0.00 C ATOM 1628 CE1 TYR A 610 11.011 -2.065 9.231 1.00 0.00 C ATOM 1629 CE2 TYR A 610 8.635 -1.494 9.270 1.00 0.00 C ATOM 1630 CZ TYR A 610 9.903 -1.481 9.887 1.00 0.00 C ATOM 1631 OH TYR A 610 10.046 -0.862 11.090 1.00 0.00 O ATOM 0 H TYR A 610 8.364 -5.366 4.631 1.00 0.00 H new ATOM 0 HA TYR A 610 11.010 -4.668 5.754 1.00 0.00 H new ATOM 0 HB2 TYR A 610 9.835 -2.659 5.248 1.00 0.00 H new ATOM 0 HB3 TYR A 610 8.305 -3.320 5.790 1.00 0.00 H new ATOM 0 HD1 TYR A 610 11.688 -3.099 7.462 1.00 0.00 H new ATOM 0 HD2 TYR A 610 7.518 -2.051 7.516 1.00 0.00 H new ATOM 0 HE1 TYR A 610 11.983 -2.059 9.701 1.00 0.00 H new ATOM 0 HE2 TYR A 610 7.783 -1.063 9.775 1.00 0.00 H new ATOM 0 HH TYR A 610 9.177 -0.520 11.387 1.00 0.00 H new ATOM 1641 N VAL A 611 8.441 -6.116 7.260 1.00 0.00 N ATOM 1642 CA VAL A 611 8.068 -6.854 8.473 1.00 0.00 C ATOM 1643 C VAL A 611 7.243 -8.124 8.179 1.00 0.00 C ATOM 1644 O VAL A 611 7.591 -9.189 8.688 1.00 0.00 O ATOM 1645 CB VAL A 611 7.391 -5.873 9.460 1.00 0.00 C ATOM 1646 CG1 VAL A 611 6.635 -6.545 10.612 1.00 0.00 C ATOM 1647 CG2 VAL A 611 8.438 -4.952 10.103 1.00 0.00 C ATOM 0 H VAL A 611 7.663 -5.987 6.614 1.00 0.00 H new ATOM 0 HA VAL A 611 8.967 -7.246 8.948 1.00 0.00 H new ATOM 0 HB VAL A 611 6.671 -5.330 8.848 1.00 0.00 H new ATOM 0 HG11 VAL A 611 6.194 -5.781 11.252 1.00 0.00 H new ATOM 0 HG12 VAL A 611 5.847 -7.180 10.208 1.00 0.00 H new ATOM 0 HG13 VAL A 611 7.327 -7.152 11.196 1.00 0.00 H new ATOM 0 HG21 VAL A 611 7.946 -4.268 10.794 1.00 0.00 H new ATOM 0 HG22 VAL A 611 9.168 -5.553 10.645 1.00 0.00 H new ATOM 0 HG23 VAL A 611 8.945 -4.380 9.326 1.00 0.00 H new ATOM 1657 N THR A 612 6.188 -8.084 7.351 1.00 0.00 N ATOM 1658 CA THR A 612 5.372 -9.270 7.011 1.00 0.00 C ATOM 1659 C THR A 612 6.236 -10.441 6.516 1.00 0.00 C ATOM 1660 O THR A 612 6.019 -11.598 6.866 1.00 0.00 O ATOM 1661 CB THR A 612 4.273 -8.903 5.984 1.00 0.00 C ATOM 1662 OG1 THR A 612 3.652 -10.047 5.429 1.00 0.00 O ATOM 1663 CG2 THR A 612 4.782 -8.102 4.784 1.00 0.00 C ATOM 0 H THR A 612 5.872 -7.228 6.895 1.00 0.00 H new ATOM 0 HA THR A 612 4.883 -9.605 7.926 1.00 0.00 H new ATOM 0 HB THR A 612 3.580 -8.303 6.574 1.00 0.00 H new ATOM 0 HG1 THR A 612 2.813 -10.227 5.903 1.00 0.00 H new ATOM 0 HG21 THR A 612 3.951 -7.885 4.112 1.00 0.00 H new ATOM 0 HG22 THR A 612 5.222 -7.167 5.131 1.00 0.00 H new ATOM 0 HG23 THR A 612 5.536 -8.682 4.253 1.00 0.00 H new ATOM 1671 N HIS A 613 7.213 -10.123 5.676 1.00 0.00 N ATOM 1672 CA HIS A 613 8.170 -10.989 5.012 1.00 0.00 C ATOM 1673 C HIS A 613 9.525 -10.944 5.738 1.00 0.00 C ATOM 1674 O HIS A 613 10.517 -11.376 5.152 1.00 0.00 O ATOM 1675 CB HIS A 613 8.280 -10.531 3.539 1.00 0.00 C ATOM 1676 CG HIS A 613 7.223 -11.002 2.577 1.00 0.00 C ATOM 1677 ND1 HIS A 613 5.882 -11.243 2.832 1.00 0.00 N ATOM 1678 CD2 HIS A 613 7.449 -11.182 1.242 1.00 0.00 C ATOM 1679 CE1 HIS A 613 5.316 -11.584 1.655 1.00 0.00 C ATOM 1680 NE2 HIS A 613 6.251 -11.573 0.684 1.00 0.00 N ATOM 0 H HIS A 613 7.367 -9.148 5.418 1.00 0.00 H new ATOM 0 HA HIS A 613 7.840 -12.028 5.038 1.00 0.00 H new ATOM 0 HB2 HIS A 613 8.283 -9.441 3.526 1.00 0.00 H new ATOM 0 HB3 HIS A 613 9.248 -10.856 3.158 1.00 0.00 H new ATOM 0 HD2 HIS A 613 8.386 -11.044 0.723 1.00 0.00 H new ATOM 0 HE1 HIS A 613 4.274 -11.828 1.513 1.00 0.00 H new ATOM 0 HE2 HIS A 613 6.098 -11.813 -0.296 1.00 0.00 H new ATOM 1689 N GLY A 614 9.611 -10.385 6.950 1.00 0.00 N ATOM 1690 CA GLY A 614 10.722 -10.651 7.853 1.00 0.00 C ATOM 1691 C GLY A 614 11.988 -9.810 7.665 1.00 0.00 C ATOM 1692 O GLY A 614 13.022 -10.199 8.202 1.00 0.00 O ATOM 0 H GLY A 614 8.915 -9.741 7.325 1.00 0.00 H new ATOM 0 HA2 GLY A 614 10.370 -10.509 8.875 1.00 0.00 H new ATOM 0 HA3 GLY A 614 10.995 -11.701 7.753 1.00 0.00 H new ATOM 1696 N PHE A 615 11.962 -8.710 6.902 1.00 0.00 N ATOM 1697 CA PHE A 615 13.186 -7.936 6.627 1.00 0.00 C ATOM 1698 C PHE A 615 13.549 -6.989 7.795 1.00 0.00 C ATOM 1699 O PHE A 615 13.097 -7.124 8.938 1.00 0.00 O ATOM 1700 CB PHE A 615 13.057 -7.223 5.260 1.00 0.00 C ATOM 1701 CG PHE A 615 13.337 -8.037 3.995 1.00 0.00 C ATOM 1702 CD1 PHE A 615 13.577 -9.427 4.012 1.00 0.00 C ATOM 1703 CD2 PHE A 615 13.387 -7.362 2.760 1.00 0.00 C ATOM 1704 CE1 PHE A 615 13.886 -10.109 2.820 1.00 0.00 C ATOM 1705 CE2 PHE A 615 13.660 -8.044 1.565 1.00 0.00 C ATOM 1706 CZ PHE A 615 13.918 -9.424 1.593 1.00 0.00 C ATOM 0 H PHE A 615 11.118 -8.336 6.467 1.00 0.00 H new ATOM 0 HA PHE A 615 14.032 -8.619 6.555 1.00 0.00 H new ATOM 0 HB2 PHE A 615 12.044 -6.827 5.185 1.00 0.00 H new ATOM 0 HB3 PHE A 615 13.734 -6.369 5.264 1.00 0.00 H new ATOM 0 HD1 PHE A 615 13.523 -9.970 4.944 1.00 0.00 H new ATOM 0 HD2 PHE A 615 13.211 -6.297 2.732 1.00 0.00 H new ATOM 0 HE1 PHE A 615 14.100 -11.167 2.848 1.00 0.00 H new ATOM 0 HE2 PHE A 615 13.672 -7.510 0.627 1.00 0.00 H new ATOM 0 HZ PHE A 615 14.139 -9.955 0.679 1.00 0.00 H new ATOM 1716 N ASN A 616 14.454 -6.050 7.513 1.00 0.00 N ATOM 1717 CA ASN A 616 14.748 -4.855 8.292 1.00 0.00 C ATOM 1718 C ASN A 616 14.454 -3.659 7.397 1.00 0.00 C ATOM 1719 O ASN A 616 14.398 -3.807 6.175 1.00 0.00 O ATOM 1720 CB ASN A 616 16.239 -4.786 8.642 1.00 0.00 C ATOM 1721 CG ASN A 616 16.730 -5.878 9.577 1.00 0.00 C ATOM 1722 OD1 ASN A 616 15.965 -6.485 10.317 1.00 0.00 O ATOM 1723 ND2 ASN A 616 18.021 -6.120 9.597 1.00 0.00 N ATOM 0 H ASN A 616 15.037 -6.112 6.678 1.00 0.00 H new ATOM 0 HA ASN A 616 14.157 -4.865 9.208 1.00 0.00 H new ATOM 0 HB2 ASN A 616 16.816 -4.833 7.719 1.00 0.00 H new ATOM 0 HB3 ASN A 616 16.445 -3.818 9.098 1.00 0.00 H new ATOM 0 HD21 ASN A 616 18.399 -6.821 10.234 1.00 0.00 H new ATOM 0 HD22 ASN A 616 18.646 -5.607 8.975 1.00 0.00 H new ATOM 1730 N LEU A 617 14.380 -2.462 7.981 1.00 0.00 N ATOM 1731 CA LEU A 617 14.107 -1.211 7.274 1.00 0.00 C ATOM 1732 C LEU A 617 15.089 -0.955 6.129 1.00 0.00 C ATOM 1733 O LEU A 617 14.707 -0.374 5.118 1.00 0.00 O ATOM 1734 CB LEU A 617 14.158 -0.051 8.287 1.00 0.00 C ATOM 1735 CG LEU A 617 13.491 1.250 7.790 1.00 0.00 C ATOM 1736 CD1 LEU A 617 11.972 1.105 7.639 1.00 0.00 C ATOM 1737 CD2 LEU A 617 13.761 2.421 8.746 1.00 0.00 C ATOM 0 H LEU A 617 14.512 -2.333 8.984 1.00 0.00 H new ATOM 0 HA LEU A 617 13.117 -1.285 6.823 1.00 0.00 H new ATOM 0 HB2 LEU A 617 13.671 -0.367 9.210 1.00 0.00 H new ATOM 0 HB3 LEU A 617 15.199 0.158 8.532 1.00 0.00 H new ATOM 0 HG LEU A 617 13.933 1.451 6.814 1.00 0.00 H new ATOM 0 HD11 LEU A 617 11.550 2.046 7.287 1.00 0.00 H new ATOM 0 HD12 LEU A 617 11.752 0.317 6.919 1.00 0.00 H new ATOM 0 HD13 LEU A 617 11.533 0.849 8.603 1.00 0.00 H new ATOM 0 HD21 LEU A 617 13.277 3.320 8.365 1.00 0.00 H new ATOM 0 HD22 LEU A 617 13.363 2.184 9.733 1.00 0.00 H new ATOM 0 HD23 LEU A 617 14.835 2.591 8.819 1.00 0.00 H new ATOM 1749 N GLU A 618 16.341 -1.379 6.291 1.00 0.00 N ATOM 1750 CA GLU A 618 17.418 -1.124 5.338 1.00 0.00 C ATOM 1751 C GLU A 618 17.205 -1.985 4.092 1.00 0.00 C ATOM 1752 O GLU A 618 17.175 -1.514 2.957 1.00 0.00 O ATOM 1753 CB GLU A 618 18.746 -1.434 6.048 1.00 0.00 C ATOM 1754 CG GLU A 618 19.966 -1.079 5.201 1.00 0.00 C ATOM 1755 CD GLU A 618 21.283 -1.361 5.935 1.00 0.00 C ATOM 1756 OE1 GLU A 618 21.762 -0.470 6.674 1.00 0.00 O ATOM 1757 OE2 GLU A 618 21.916 -2.413 5.683 1.00 0.00 O ATOM 0 H GLU A 618 16.640 -1.919 7.103 1.00 0.00 H new ATOM 0 HA GLU A 618 17.432 -0.086 5.007 1.00 0.00 H new ATOM 0 HB2 GLU A 618 18.788 -0.882 6.987 1.00 0.00 H new ATOM 0 HB3 GLU A 618 18.780 -2.494 6.299 1.00 0.00 H new ATOM 0 HG2 GLU A 618 19.940 -1.650 4.273 1.00 0.00 H new ATOM 0 HG3 GLU A 618 19.923 -0.025 4.928 1.00 0.00 H new ATOM 1764 N GLU A 619 17.007 -3.273 4.337 1.00 0.00 N ATOM 1765 CA GLU A 619 16.858 -4.337 3.357 1.00 0.00 C ATOM 1766 C GLU A 619 15.574 -4.125 2.561 1.00 0.00 C ATOM 1767 O GLU A 619 15.519 -4.389 1.356 1.00 0.00 O ATOM 1768 CB GLU A 619 16.817 -5.665 4.122 1.00 0.00 C ATOM 1769 CG GLU A 619 18.069 -5.831 5.008 1.00 0.00 C ATOM 1770 CD GLU A 619 19.307 -6.320 4.242 1.00 0.00 C ATOM 1771 OE1 GLU A 619 19.604 -5.830 3.126 1.00 0.00 O ATOM 1772 OE2 GLU A 619 20.002 -7.227 4.767 1.00 0.00 O ATOM 0 H GLU A 619 16.942 -3.625 5.292 1.00 0.00 H new ATOM 0 HA GLU A 619 17.688 -4.342 2.651 1.00 0.00 H new ATOM 0 HB2 GLU A 619 15.921 -5.705 4.741 1.00 0.00 H new ATOM 0 HB3 GLU A 619 16.754 -6.493 3.417 1.00 0.00 H new ATOM 0 HG2 GLU A 619 18.299 -4.876 5.480 1.00 0.00 H new ATOM 0 HG3 GLU A 619 17.846 -6.536 5.808 1.00 0.00 H new ATOM 1779 N ALA A 620 14.552 -3.625 3.253 1.00 0.00 N ATOM 1780 CA ALA A 620 13.289 -3.208 2.702 1.00 0.00 C ATOM 1781 C ALA A 620 13.499 -2.094 1.690 1.00 0.00 C ATOM 1782 O ALA A 620 13.025 -2.197 0.556 1.00 0.00 O ATOM 1783 CB ALA A 620 12.399 -2.733 3.857 1.00 0.00 C ATOM 0 H ALA A 620 14.597 -3.498 4.264 1.00 0.00 H new ATOM 0 HA ALA A 620 12.809 -4.038 2.184 1.00 0.00 H new ATOM 0 HB1 ALA A 620 11.434 -2.411 3.464 1.00 0.00 H new ATOM 0 HB2 ALA A 620 12.249 -3.551 4.561 1.00 0.00 H new ATOM 0 HB3 ALA A 620 12.880 -1.898 4.367 1.00 0.00 H new ATOM 1789 N ALA A 621 14.144 -1.012 2.128 1.00 0.00 N ATOM 1790 CA ALA A 621 14.350 0.210 1.375 1.00 0.00 C ATOM 1791 C ALA A 621 15.160 -0.080 0.107 1.00 0.00 C ATOM 1792 O ALA A 621 14.723 0.306 -0.978 1.00 0.00 O ATOM 1793 CB ALA A 621 15.047 1.204 2.309 1.00 0.00 C ATOM 0 H ALA A 621 14.553 -0.969 3.061 1.00 0.00 H new ATOM 0 HA ALA A 621 13.407 0.639 1.037 1.00 0.00 H new ATOM 0 HB1 ALA A 621 15.221 2.141 1.779 1.00 0.00 H new ATOM 0 HB2 ALA A 621 14.416 1.391 3.178 1.00 0.00 H new ATOM 0 HB3 ALA A 621 16.001 0.789 2.635 1.00 0.00 H new ATOM 1799 N ARG A 622 16.266 -0.830 0.221 1.00 0.00 N ATOM 1800 CA ARG A 622 17.080 -1.265 -0.910 1.00 0.00 C ATOM 1801 C ARG A 622 16.234 -1.942 -1.974 1.00 0.00 C ATOM 1802 O ARG A 622 16.235 -1.508 -3.127 1.00 0.00 O ATOM 1803 CB ARG A 622 18.142 -2.243 -0.437 1.00 0.00 C ATOM 1804 CG ARG A 622 19.329 -1.546 0.216 1.00 0.00 C ATOM 1805 CD ARG A 622 20.231 -2.681 0.673 1.00 0.00 C ATOM 1806 NE ARG A 622 21.445 -2.185 1.326 1.00 0.00 N ATOM 1807 CZ ARG A 622 21.859 -2.527 2.551 1.00 0.00 C ATOM 1808 NH1 ARG A 622 21.346 -3.553 3.230 1.00 0.00 N ATOM 1809 NH2 ARG A 622 22.784 -1.792 3.147 1.00 0.00 N ATOM 0 H ARG A 622 16.621 -1.154 1.121 1.00 0.00 H new ATOM 0 HA ARG A 622 17.545 -0.379 -1.342 1.00 0.00 H new ATOM 0 HB2 ARG A 622 17.698 -2.940 0.274 1.00 0.00 H new ATOM 0 HB3 ARG A 622 18.492 -2.832 -1.285 1.00 0.00 H new ATOM 0 HG2 ARG A 622 19.841 -0.891 -0.488 1.00 0.00 H new ATOM 0 HG3 ARG A 622 19.013 -0.927 1.056 1.00 0.00 H new ATOM 0 HD2 ARG A 622 19.684 -3.324 1.363 1.00 0.00 H new ATOM 0 HD3 ARG A 622 20.505 -3.295 -0.185 1.00 0.00 H new ATOM 0 HE ARG A 622 22.021 -1.525 0.804 1.00 0.00 H new ATOM 0 HH11 ARG A 622 20.603 -4.117 2.817 1.00 0.00 H new ATOM 0 HH12 ARG A 622 21.696 -3.774 4.162 1.00 0.00 H new ATOM 0 HH21 ARG A 622 23.172 -0.977 2.672 1.00 0.00 H new ATOM 0 HH22 ARG A 622 23.109 -2.041 4.081 1.00 0.00 H new ATOM 1823 N CYS A 623 15.508 -2.990 -1.565 1.00 0.00 N ATOM 1824 CA CYS A 623 14.663 -3.770 -2.454 1.00 0.00 C ATOM 1825 C CYS A 623 13.680 -2.839 -3.165 1.00 0.00 C ATOM 1826 O CYS A 623 13.444 -2.957 -4.361 1.00 0.00 O ATOM 1827 CB CYS A 623 13.932 -4.855 -1.643 1.00 0.00 C ATOM 1828 SG CYS A 623 13.493 -6.253 -2.711 1.00 0.00 S ATOM 0 H CYS A 623 15.496 -3.316 -0.599 1.00 0.00 H new ATOM 0 HA CYS A 623 15.267 -4.266 -3.213 1.00 0.00 H new ATOM 0 HB2 CYS A 623 14.568 -5.198 -0.827 1.00 0.00 H new ATOM 0 HB3 CYS A 623 13.032 -4.437 -1.192 1.00 0.00 H new ATOM 0 HG CYS A 623 13.689 -7.367 -2.070 1.00 0.00 H new ATOM 1834 N MET A 624 13.121 -1.877 -2.434 1.00 0.00 N ATOM 1835 CA MET A 624 12.152 -0.924 -2.946 1.00 0.00 C ATOM 1836 C MET A 624 12.705 0.037 -3.997 1.00 0.00 C ATOM 1837 O MET A 624 11.949 0.443 -4.875 1.00 0.00 O ATOM 1838 CB MET A 624 11.526 -0.185 -1.766 1.00 0.00 C ATOM 1839 CG MET A 624 10.071 -0.640 -1.650 1.00 0.00 C ATOM 1840 SD MET A 624 9.009 0.230 -2.820 1.00 0.00 S ATOM 1841 CE MET A 624 8.944 1.734 -1.829 1.00 0.00 C ATOM 0 H MET A 624 13.338 -1.739 -1.447 1.00 0.00 H new ATOM 0 HA MET A 624 11.390 -1.487 -3.485 1.00 0.00 H new ATOM 0 HB2 MET A 624 12.069 -0.403 -0.847 1.00 0.00 H new ATOM 0 HB3 MET A 624 11.578 0.893 -1.919 1.00 0.00 H new ATOM 0 HG2 MET A 624 10.009 -1.713 -1.830 1.00 0.00 H new ATOM 0 HG3 MET A 624 9.714 -0.466 -0.635 1.00 0.00 H new ATOM 0 HE1 MET A 624 8.024 2.275 -2.049 1.00 0.00 H new ATOM 0 HE2 MET A 624 8.967 1.474 -0.771 1.00 0.00 H new ATOM 0 HE3 MET A 624 9.801 2.364 -2.067 1.00 0.00 H new ATOM 1851 N ARG A 625 13.995 0.378 -3.999 1.00 0.00 N ATOM 1852 CA ARG A 625 14.580 1.085 -5.146 1.00 0.00 C ATOM 1853 C ARG A 625 14.530 0.254 -6.423 1.00 0.00 C ATOM 1854 O ARG A 625 14.437 0.809 -7.521 1.00 0.00 O ATOM 1855 CB ARG A 625 16.029 1.472 -4.871 1.00 0.00 C ATOM 1856 CG ARG A 625 16.139 2.319 -3.604 1.00 0.00 C ATOM 1857 CD ARG A 625 17.407 3.149 -3.667 1.00 0.00 C ATOM 1858 NE ARG A 625 17.228 4.359 -4.474 1.00 0.00 N ATOM 1859 CZ ARG A 625 18.212 5.142 -4.914 1.00 0.00 C ATOM 1860 NH1 ARG A 625 19.492 4.836 -4.700 1.00 0.00 N ATOM 1861 NH2 ARG A 625 17.888 6.213 -5.627 1.00 0.00 N ATOM 0 H ARG A 625 14.645 0.183 -3.238 1.00 0.00 H new ATOM 0 HA ARG A 625 13.977 1.982 -5.289 1.00 0.00 H new ATOM 0 HB2 ARG A 625 16.635 0.573 -4.765 1.00 0.00 H new ATOM 0 HB3 ARG A 625 16.428 2.027 -5.720 1.00 0.00 H new ATOM 0 HG2 ARG A 625 15.269 2.969 -3.510 1.00 0.00 H new ATOM 0 HG3 ARG A 625 16.154 1.677 -2.723 1.00 0.00 H new ATOM 0 HD2 ARG A 625 17.709 3.427 -2.657 1.00 0.00 H new ATOM 0 HD3 ARG A 625 18.214 2.548 -4.087 1.00 0.00 H new ATOM 0 HE ARG A 625 16.274 4.623 -4.718 1.00 0.00 H new ATOM 0 HH11 ARG A 625 19.735 3.987 -4.190 1.00 0.00 H new ATOM 0 HH12 ARG A 625 20.228 5.451 -5.047 1.00 0.00 H new ATOM 0 HH21 ARG A 625 16.908 6.417 -5.824 1.00 0.00 H new ATOM 0 HH22 ARG A 625 18.619 6.832 -5.978 1.00 0.00 H new ATOM 1875 N SER A 626 14.563 -1.070 -6.295 1.00 0.00 N ATOM 1876 CA SER A 626 14.395 -1.976 -7.414 1.00 0.00 C ATOM 1877 C SER A 626 12.971 -1.904 -7.982 1.00 0.00 C ATOM 1878 O SER A 626 12.748 -2.384 -9.093 1.00 0.00 O ATOM 1879 CB SER A 626 14.773 -3.400 -6.973 1.00 0.00 C ATOM 1880 OG SER A 626 15.377 -4.111 -8.035 1.00 0.00 O ATOM 0 H SER A 626 14.709 -1.542 -5.403 1.00 0.00 H new ATOM 0 HA SER A 626 15.061 -1.677 -8.224 1.00 0.00 H new ATOM 0 HB2 SER A 626 15.457 -3.354 -6.125 1.00 0.00 H new ATOM 0 HB3 SER A 626 13.882 -3.929 -6.635 1.00 0.00 H new ATOM 0 HG SER A 626 15.611 -5.013 -7.733 1.00 0.00 H new ATOM 1886 N LEU A 627 11.997 -1.282 -7.300 1.00 0.00 N ATOM 1887 CA LEU A 627 10.704 -0.996 -7.894 1.00 0.00 C ATOM 1888 C LEU A 627 10.814 0.210 -8.803 1.00 0.00 C ATOM 1889 O LEU A 627 11.184 1.306 -8.388 1.00 0.00 O ATOM 1890 CB LEU A 627 9.644 -0.778 -6.812 1.00 0.00 C ATOM 1891 CG LEU A 627 8.267 -0.404 -7.373 1.00 0.00 C ATOM 1892 CD1 LEU A 627 7.668 -1.495 -8.266 1.00 0.00 C ATOM 1893 CD2 LEU A 627 7.334 -0.136 -6.197 1.00 0.00 C ATOM 0 H LEU A 627 12.092 -0.971 -6.333 1.00 0.00 H new ATOM 0 HA LEU A 627 10.391 -1.853 -8.490 1.00 0.00 H new ATOM 0 HB2 LEU A 627 9.551 -1.687 -6.217 1.00 0.00 H new ATOM 0 HB3 LEU A 627 9.980 0.011 -6.139 1.00 0.00 H new ATOM 0 HG LEU A 627 8.386 0.479 -8.000 1.00 0.00 H new ATOM 0 HD11 LEU A 627 6.694 -1.171 -8.632 1.00 0.00 H new ATOM 0 HD12 LEU A 627 8.331 -1.678 -9.112 1.00 0.00 H new ATOM 0 HD13 LEU A 627 7.552 -2.413 -7.690 1.00 0.00 H new ATOM 0 HD21 LEU A 627 6.346 0.133 -6.570 1.00 0.00 H new ATOM 0 HD22 LEU A 627 7.258 -1.032 -5.581 1.00 0.00 H new ATOM 0 HD23 LEU A 627 7.730 0.683 -5.597 1.00 0.00 H new ATOM 1905 N LYS A 628 10.460 -0.031 -10.057 1.00 0.00 N ATOM 1906 CA LYS A 628 10.573 0.866 -11.194 1.00 0.00 C ATOM 1907 C LYS A 628 9.247 1.606 -11.390 1.00 0.00 C ATOM 1908 O LYS A 628 8.814 1.830 -12.515 1.00 0.00 O ATOM 1909 CB LYS A 628 10.994 0.008 -12.402 1.00 0.00 C ATOM 1910 CG LYS A 628 12.213 -0.904 -12.122 1.00 0.00 C ATOM 1911 CD LYS A 628 13.551 -0.140 -11.983 1.00 0.00 C ATOM 1912 CE LYS A 628 13.759 0.327 -10.532 1.00 0.00 C ATOM 1913 NZ LYS A 628 14.822 1.334 -10.349 1.00 0.00 N ATOM 0 H LYS A 628 10.055 -0.928 -10.325 1.00 0.00 H new ATOM 0 HA LYS A 628 11.325 1.641 -11.049 1.00 0.00 H new ATOM 0 HB2 LYS A 628 10.151 -0.611 -12.708 1.00 0.00 H new ATOM 0 HB3 LYS A 628 11.228 0.665 -13.240 1.00 0.00 H new ATOM 0 HG2 LYS A 628 12.031 -1.466 -11.206 1.00 0.00 H new ATOM 0 HG3 LYS A 628 12.303 -1.631 -12.929 1.00 0.00 H new ATOM 0 HD2 LYS A 628 14.377 -0.784 -12.286 1.00 0.00 H new ATOM 0 HD3 LYS A 628 13.556 0.720 -12.652 1.00 0.00 H new ATOM 0 HE2 LYS A 628 12.821 0.739 -10.160 1.00 0.00 H new ATOM 0 HE3 LYS A 628 13.992 -0.542 -9.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 628 15.018 1.451 -9.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 628 15.686 1.019 -10.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 628 14.512 2.243 -10.749 1.00 0.00 H new ATOM 1927 N ALA A 629 8.552 1.897 -10.292 1.00 0.00 N ATOM 1928 CA ALA A 629 7.294 2.615 -10.276 1.00 0.00 C ATOM 1929 C ALA A 629 7.340 3.601 -9.106 1.00 0.00 C ATOM 1930 O ALA A 629 7.990 3.296 -8.091 1.00 0.00 O ATOM 1931 CB ALA A 629 6.144 1.610 -10.132 1.00 0.00 C ATOM 0 H ALA A 629 8.867 1.627 -9.360 1.00 0.00 H new ATOM 0 HA ALA A 629 7.131 3.168 -11.201 1.00 0.00 H new ATOM 0 HB1 ALA A 629 5.194 2.144 -10.119 1.00 0.00 H new ATOM 0 HB2 ALA A 629 6.159 0.917 -10.973 1.00 0.00 H new ATOM 0 HB3 ALA A 629 6.261 1.055 -9.201 1.00 0.00 H new ATOM 1937 N PRO A 630 6.669 4.762 -9.209 1.00 0.00 N ATOM 1938 CA PRO A 630 6.545 5.687 -8.095 1.00 0.00 C ATOM 1939 C PRO A 630 5.832 5.002 -6.937 1.00 0.00 C ATOM 1940 O PRO A 630 4.931 4.189 -7.133 1.00 0.00 O ATOM 1941 CB PRO A 630 5.754 6.893 -8.617 1.00 0.00 C ATOM 1942 CG PRO A 630 5.758 6.736 -10.135 1.00 0.00 C ATOM 1943 CD PRO A 630 5.895 5.234 -10.346 1.00 0.00 C ATOM 0 HA PRO A 630 7.516 6.011 -7.721 1.00 0.00 H new ATOM 0 HB2 PRO A 630 4.738 6.900 -8.223 1.00 0.00 H new ATOM 0 HB3 PRO A 630 6.219 7.831 -8.315 1.00 0.00 H new ATOM 0 HG2 PRO A 630 4.840 7.120 -10.579 1.00 0.00 H new ATOM 0 HG3 PRO A 630 6.585 7.281 -10.591 1.00 0.00 H new ATOM 0 HD2 PRO A 630 4.919 4.751 -10.387 1.00 0.00 H new ATOM 0 HD3 PRO A 630 6.400 5.012 -11.286 1.00 0.00 H new ATOM 1951 N ALA A 631 6.241 5.325 -5.716 1.00 0.00 N ATOM 1952 CA ALA A 631 5.687 4.758 -4.509 1.00 0.00 C ATOM 1953 C ALA A 631 5.948 5.708 -3.351 1.00 0.00 C ATOM 1954 O ALA A 631 7.102 5.846 -2.923 1.00 0.00 O ATOM 1955 CB ALA A 631 6.317 3.384 -4.267 1.00 0.00 C ATOM 0 H ALA A 631 6.983 6.003 -5.542 1.00 0.00 H new ATOM 0 HA ALA A 631 4.609 4.624 -4.603 1.00 0.00 H new ATOM 0 HB1 ALA A 631 5.904 2.949 -3.357 1.00 0.00 H new ATOM 0 HB2 ALA A 631 6.101 2.731 -5.112 1.00 0.00 H new ATOM 0 HB3 ALA A 631 7.396 3.492 -4.159 1.00 0.00 H new ATOM 1961 N VAL A 632 4.891 6.369 -2.874 1.00 0.00 N ATOM 1962 CA VAL A 632 4.915 6.997 -1.558 1.00 0.00 C ATOM 1963 C VAL A 632 5.086 5.857 -0.556 1.00 0.00 C ATOM 1964 O VAL A 632 4.466 4.799 -0.714 1.00 0.00 O ATOM 1965 CB VAL A 632 3.626 7.814 -1.313 1.00 0.00 C ATOM 1966 CG1 VAL A 632 3.456 8.305 0.135 1.00 0.00 C ATOM 1967 CG2 VAL A 632 3.590 9.058 -2.203 1.00 0.00 C ATOM 0 H VAL A 632 4.012 6.481 -3.380 1.00 0.00 H new ATOM 0 HA VAL A 632 5.731 7.713 -1.461 1.00 0.00 H new ATOM 0 HB VAL A 632 2.819 7.118 -1.545 1.00 0.00 H new ATOM 0 HG11 VAL A 632 2.527 8.869 0.221 1.00 0.00 H new ATOM 0 HG12 VAL A 632 3.424 7.448 0.808 1.00 0.00 H new ATOM 0 HG13 VAL A 632 4.296 8.946 0.403 1.00 0.00 H new ATOM 0 HG21 VAL A 632 2.673 9.616 -2.012 1.00 0.00 H new ATOM 0 HG22 VAL A 632 4.451 9.689 -1.982 1.00 0.00 H new ATOM 0 HG23 VAL A 632 3.620 8.757 -3.250 1.00 0.00 H new ATOM 1977 N VAL A 633 5.915 6.070 0.463 1.00 0.00 N ATOM 1978 CA VAL A 633 6.163 5.093 1.515 1.00 0.00 C ATOM 1979 C VAL A 633 5.695 5.698 2.832 1.00 0.00 C ATOM 1980 O VAL A 633 5.886 6.890 3.049 1.00 0.00 O ATOM 1981 CB VAL A 633 7.640 4.662 1.530 1.00 0.00 C ATOM 1982 CG1 VAL A 633 7.913 3.630 2.638 1.00 0.00 C ATOM 1983 CG2 VAL A 633 8.016 4.022 0.190 1.00 0.00 C ATOM 0 H VAL A 633 6.439 6.937 0.581 1.00 0.00 H new ATOM 0 HA VAL A 633 5.601 4.176 1.338 1.00 0.00 H new ATOM 0 HB VAL A 633 8.235 5.557 1.712 1.00 0.00 H new ATOM 0 HG11 VAL A 633 8.966 3.347 2.620 1.00 0.00 H new ATOM 0 HG12 VAL A 633 7.670 4.064 3.608 1.00 0.00 H new ATOM 0 HG13 VAL A 633 7.297 2.746 2.472 1.00 0.00 H new ATOM 0 HG21 VAL A 633 9.063 3.721 0.212 1.00 0.00 H new ATOM 0 HG22 VAL A 633 7.390 3.147 0.017 1.00 0.00 H new ATOM 0 HG23 VAL A 633 7.862 4.743 -0.613 1.00 0.00 H new ATOM 1993 N SER A 634 5.121 4.889 3.716 1.00 0.00 N ATOM 1994 CA SER A 634 4.670 5.292 5.033 1.00 0.00 C ATOM 1995 C SER A 634 5.358 4.406 6.055 1.00 0.00 C ATOM 1996 O SER A 634 5.160 3.188 6.039 1.00 0.00 O ATOM 1997 CB SER A 634 3.149 5.180 5.075 1.00 0.00 C ATOM 1998 OG SER A 634 2.605 5.501 6.339 1.00 0.00 O ATOM 0 H SER A 634 4.954 3.901 3.524 1.00 0.00 H new ATOM 0 HA SER A 634 4.927 6.326 5.263 1.00 0.00 H new ATOM 0 HB2 SER A 634 2.721 5.843 4.323 1.00 0.00 H new ATOM 0 HB3 SER A 634 2.858 4.164 4.808 1.00 0.00 H new ATOM 0 HG SER A 634 1.629 5.414 6.307 1.00 0.00 H new ATOM 2004 N VAL A 635 6.126 5.001 6.961 1.00 0.00 N ATOM 2005 CA VAL A 635 6.610 4.328 8.156 1.00 0.00 C ATOM 2006 C VAL A 635 5.819 4.831 9.356 1.00 0.00 C ATOM 2007 O VAL A 635 5.556 6.025 9.495 1.00 0.00 O ATOM 2008 CB VAL A 635 8.122 4.528 8.358 1.00 0.00 C ATOM 2009 CG1 VAL A 635 8.913 3.495 7.558 1.00 0.00 C ATOM 2010 CG2 VAL A 635 8.621 5.925 7.981 1.00 0.00 C ATOM 0 H VAL A 635 6.431 5.971 6.884 1.00 0.00 H new ATOM 0 HA VAL A 635 6.458 3.255 8.042 1.00 0.00 H new ATOM 0 HB VAL A 635 8.287 4.402 9.428 1.00 0.00 H new ATOM 0 HG11 VAL A 635 9.980 3.653 7.714 1.00 0.00 H new ATOM 0 HG12 VAL A 635 8.642 2.493 7.890 1.00 0.00 H new ATOM 0 HG13 VAL A 635 8.682 3.601 6.498 1.00 0.00 H new ATOM 0 HG21 VAL A 635 9.696 5.986 8.152 1.00 0.00 H new ATOM 0 HG22 VAL A 635 8.409 6.115 6.929 1.00 0.00 H new ATOM 0 HG23 VAL A 635 8.114 6.670 8.594 1.00 0.00 H new ATOM 2020 N SER A 636 5.517 3.905 10.259 1.00 0.00 N ATOM 2021 CA SER A 636 4.780 4.101 11.497 1.00 0.00 C ATOM 2022 C SER A 636 5.563 4.915 12.541 1.00 0.00 C ATOM 2023 O SER A 636 5.174 4.943 13.718 1.00 0.00 O ATOM 2024 CB SER A 636 4.391 2.714 12.025 1.00 0.00 C ATOM 2025 OG SER A 636 5.541 1.889 12.175 1.00 0.00 O ATOM 0 H SER A 636 5.801 2.933 10.135 1.00 0.00 H new ATOM 0 HA SER A 636 3.889 4.696 11.297 1.00 0.00 H new ATOM 0 HB2 SER A 636 3.883 2.815 12.984 1.00 0.00 H new ATOM 0 HB3 SER A 636 3.687 2.243 11.339 1.00 0.00 H new ATOM 0 HG SER A 636 5.271 1.010 12.514 1.00 0.00 H new ATOM 2031 N SER A 637 6.692 5.532 12.171 1.00 0.00 N ATOM 2032 CA SER A 637 7.317 6.553 12.994 1.00 0.00 C ATOM 2033 C SER A 637 7.910 7.665 12.120 1.00 0.00 C ATOM 2034 O SER A 637 8.498 7.376 11.075 1.00 0.00 O ATOM 2035 CB SER A 637 8.369 5.934 13.921 1.00 0.00 C ATOM 2036 OG SER A 637 9.081 4.868 13.308 1.00 0.00 O ATOM 0 H SER A 637 7.187 5.335 11.301 1.00 0.00 H new ATOM 0 HA SER A 637 6.553 7.006 13.626 1.00 0.00 H new ATOM 0 HB2 SER A 637 9.074 6.706 14.230 1.00 0.00 H new ATOM 0 HB3 SER A 637 7.881 5.568 14.824 1.00 0.00 H new ATOM 0 HG SER A 637 9.740 4.509 13.939 1.00 0.00 H new ATOM 2042 N PRO A 638 7.842 8.928 12.570 1.00 0.00 N ATOM 2043 CA PRO A 638 8.398 10.070 11.863 1.00 0.00 C ATOM 2044 C PRO A 638 9.916 9.981 11.824 1.00 0.00 C ATOM 2045 O PRO A 638 10.536 10.288 10.808 1.00 0.00 O ATOM 2046 CB PRO A 638 7.916 11.301 12.636 1.00 0.00 C ATOM 2047 CG PRO A 638 7.722 10.783 14.058 1.00 0.00 C ATOM 2048 CD PRO A 638 7.283 9.341 13.844 1.00 0.00 C ATOM 0 HA PRO A 638 8.074 10.113 10.823 1.00 0.00 H new ATOM 0 HB2 PRO A 638 8.648 12.108 12.600 1.00 0.00 H new ATOM 0 HB3 PRO A 638 6.987 11.695 12.223 1.00 0.00 H new ATOM 0 HG2 PRO A 638 8.643 10.842 14.638 1.00 0.00 H new ATOM 0 HG3 PRO A 638 6.969 11.358 14.597 1.00 0.00 H new ATOM 0 HD2 PRO A 638 7.641 8.702 14.651 1.00 0.00 H new ATOM 0 HD3 PRO A 638 6.196 9.263 13.835 1.00 0.00 H new ATOM 2056 N ASP A 639 10.526 9.500 12.906 1.00 0.00 N ATOM 2057 CA ASP A 639 11.975 9.514 13.076 1.00 0.00 C ATOM 2058 C ASP A 639 12.697 8.533 12.152 1.00 0.00 C ATOM 2059 O ASP A 639 13.917 8.583 11.999 1.00 0.00 O ATOM 2060 CB ASP A 639 12.290 9.189 14.535 1.00 0.00 C ATOM 2061 CG ASP A 639 13.601 9.855 14.924 1.00 0.00 C ATOM 2062 OD1 ASP A 639 13.671 11.106 14.841 1.00 0.00 O ATOM 2063 OD2 ASP A 639 14.580 9.152 15.244 1.00 0.00 O ATOM 0 H ASP A 639 10.025 9.088 13.693 1.00 0.00 H new ATOM 0 HA ASP A 639 12.336 10.506 12.807 1.00 0.00 H new ATOM 0 HB2 ASP A 639 11.485 9.540 15.180 1.00 0.00 H new ATOM 0 HB3 ASP A 639 12.362 8.110 14.672 1.00 0.00 H new ATOM 2068 N ALA A 640 11.908 7.647 11.547 1.00 0.00 N ATOM 2069 CA ALA A 640 12.271 6.605 10.606 1.00 0.00 C ATOM 2070 C ALA A 640 12.037 7.034 9.157 1.00 0.00 C ATOM 2071 O ALA A 640 12.659 6.437 8.283 1.00 0.00 O ATOM 2072 CB ALA A 640 11.471 5.329 10.900 1.00 0.00 C ATOM 0 H ALA A 640 10.904 7.646 11.725 1.00 0.00 H new ATOM 0 HA ALA A 640 13.337 6.412 10.729 1.00 0.00 H new ATOM 0 HB1 ALA A 640 11.750 4.552 10.188 1.00 0.00 H new ATOM 0 HB2 ALA A 640 11.688 4.989 11.912 1.00 0.00 H new ATOM 0 HB3 ALA A 640 10.405 5.539 10.808 1.00 0.00 H new ATOM 2078 N VAL A 641 11.207 8.054 8.865 1.00 0.00 N ATOM 2079 CA VAL A 641 11.151 8.620 7.508 1.00 0.00 C ATOM 2080 C VAL A 641 12.552 9.063 7.089 1.00 0.00 C ATOM 2081 O VAL A 641 12.941 8.859 5.941 1.00 0.00 O ATOM 2082 CB VAL A 641 10.167 9.807 7.439 1.00 0.00 C ATOM 2083 CG1 VAL A 641 10.127 10.508 6.071 1.00 0.00 C ATOM 2084 CG2 VAL A 641 8.750 9.356 7.771 1.00 0.00 C ATOM 0 H VAL A 641 10.579 8.494 9.537 1.00 0.00 H new ATOM 0 HA VAL A 641 10.790 7.853 6.822 1.00 0.00 H new ATOM 0 HB VAL A 641 10.540 10.521 8.174 1.00 0.00 H new ATOM 0 HG11 VAL A 641 9.412 11.330 6.104 1.00 0.00 H new ATOM 0 HG12 VAL A 641 11.117 10.897 5.832 1.00 0.00 H new ATOM 0 HG13 VAL A 641 9.823 9.794 5.305 1.00 0.00 H new ATOM 0 HG21 VAL A 641 8.074 10.209 7.716 1.00 0.00 H new ATOM 0 HG22 VAL A 641 8.433 8.596 7.057 1.00 0.00 H new ATOM 0 HG23 VAL A 641 8.727 8.940 8.778 1.00 0.00 H new ATOM 2094 N THR A 642 13.309 9.614 8.036 1.00 0.00 N ATOM 2095 CA THR A 642 14.666 10.086 7.918 1.00 0.00 C ATOM 2096 C THR A 642 15.554 8.898 7.562 1.00 0.00 C ATOM 2097 O THR A 642 16.243 8.916 6.544 1.00 0.00 O ATOM 2098 CB THR A 642 15.020 10.660 9.307 1.00 0.00 C ATOM 2099 OG1 THR A 642 14.074 11.614 9.755 1.00 0.00 O ATOM 2100 CG2 THR A 642 16.399 11.310 9.317 1.00 0.00 C ATOM 0 H THR A 642 12.948 9.748 8.981 1.00 0.00 H new ATOM 0 HA THR A 642 14.800 10.844 7.146 1.00 0.00 H new ATOM 0 HB THR A 642 15.011 9.806 9.984 1.00 0.00 H new ATOM 0 HG1 THR A 642 14.339 11.948 10.638 1.00 0.00 H new ATOM 0 HG21 THR A 642 16.610 11.701 10.312 1.00 0.00 H new ATOM 0 HG22 THR A 642 17.153 10.569 9.051 1.00 0.00 H new ATOM 0 HG23 THR A 642 16.422 12.126 8.594 1.00 0.00 H new ATOM 2108 N THR A 643 15.503 7.848 8.383 1.00 0.00 N ATOM 2109 CA THR A 643 16.334 6.676 8.237 1.00 0.00 C ATOM 2110 C THR A 643 16.095 6.020 6.872 1.00 0.00 C ATOM 2111 O THR A 643 17.038 5.767 6.122 1.00 0.00 O ATOM 2112 CB THR A 643 16.032 5.736 9.414 1.00 0.00 C ATOM 2113 OG1 THR A 643 16.108 6.457 10.629 1.00 0.00 O ATOM 2114 CG2 THR A 643 16.968 4.531 9.469 1.00 0.00 C ATOM 0 H THR A 643 14.868 7.798 9.179 1.00 0.00 H new ATOM 0 HA THR A 643 17.392 6.936 8.263 1.00 0.00 H new ATOM 0 HB THR A 643 15.024 5.348 9.264 1.00 0.00 H new ATOM 0 HG1 THR A 643 15.913 5.856 11.379 1.00 0.00 H new ATOM 0 HG21 THR A 643 16.705 3.905 10.321 1.00 0.00 H new ATOM 0 HG22 THR A 643 16.871 3.953 8.550 1.00 0.00 H new ATOM 0 HG23 THR A 643 17.997 4.874 9.575 1.00 0.00 H new ATOM 2122 N TYR A 644 14.824 5.800 6.531 1.00 0.00 N ATOM 2123 CA TYR A 644 14.390 5.190 5.293 1.00 0.00 C ATOM 2124 C TYR A 644 14.866 6.001 4.085 1.00 0.00 C ATOM 2125 O TYR A 644 15.481 5.450 3.172 1.00 0.00 O ATOM 2126 CB TYR A 644 12.867 5.047 5.347 1.00 0.00 C ATOM 2127 CG TYR A 644 12.327 4.235 4.201 1.00 0.00 C ATOM 2128 CD1 TYR A 644 12.010 4.858 2.986 1.00 0.00 C ATOM 2129 CD2 TYR A 644 12.196 2.846 4.336 1.00 0.00 C ATOM 2130 CE1 TYR A 644 11.564 4.093 1.899 1.00 0.00 C ATOM 2131 CE2 TYR A 644 11.766 2.067 3.253 1.00 0.00 C ATOM 2132 CZ TYR A 644 11.471 2.688 2.017 1.00 0.00 C ATOM 2133 OH TYR A 644 11.073 1.943 0.950 1.00 0.00 O ATOM 0 H TYR A 644 14.046 6.055 7.140 1.00 0.00 H new ATOM 0 HA TYR A 644 14.833 4.201 5.176 1.00 0.00 H new ATOM 0 HB2 TYR A 644 12.582 4.577 6.288 1.00 0.00 H new ATOM 0 HB3 TYR A 644 12.411 6.037 5.334 1.00 0.00 H new ATOM 0 HD1 TYR A 644 12.109 5.929 2.887 1.00 0.00 H new ATOM 0 HD2 TYR A 644 12.428 2.374 5.279 1.00 0.00 H new ATOM 0 HE1 TYR A 644 11.292 4.577 0.973 1.00 0.00 H new ATOM 0 HE2 TYR A 644 11.660 0.998 3.362 1.00 0.00 H new ATOM 0 HH TYR A 644 11.063 0.995 1.198 1.00 0.00 H new ATOM 2143 N ASN A 645 14.633 7.319 4.101 1.00 0.00 N ATOM 2144 CA ASN A 645 15.126 8.247 3.073 1.00 0.00 C ATOM 2145 C ASN A 645 16.636 8.137 2.930 1.00 0.00 C ATOM 2146 O ASN A 645 17.172 8.178 1.822 1.00 0.00 O ATOM 2147 CB ASN A 645 14.811 9.706 3.460 1.00 0.00 C ATOM 2148 CG ASN A 645 13.583 10.234 2.755 1.00 0.00 C ATOM 2149 OD1 ASN A 645 13.648 10.735 1.635 1.00 0.00 O ATOM 2150 ND2 ASN A 645 12.434 10.132 3.384 1.00 0.00 N ATOM 0 H ASN A 645 14.092 7.777 4.834 1.00 0.00 H new ATOM 0 HA ASN A 645 14.631 7.982 2.139 1.00 0.00 H new ATOM 0 HB2 ASN A 645 14.664 9.770 4.538 1.00 0.00 H new ATOM 0 HB3 ASN A 645 15.666 10.337 3.217 1.00 0.00 H new ATOM 0 HD21 ASN A 645 11.579 10.471 2.943 1.00 0.00 H new ATOM 0 HD22 ASN A 645 12.397 9.714 4.313 1.00 0.00 H new ATOM 2157 N GLY A 646 17.313 7.990 4.064 1.00 0.00 N ATOM 2158 CA GLY A 646 18.738 7.818 4.156 1.00 0.00 C ATOM 2159 C GLY A 646 19.193 6.606 3.366 1.00 0.00 C ATOM 2160 O GLY A 646 20.170 6.693 2.621 1.00 0.00 O ATOM 0 H GLY A 646 16.855 7.989 4.975 1.00 0.00 H new ATOM 0 HA2 GLY A 646 19.240 8.710 3.781 1.00 0.00 H new ATOM 0 HA3 GLY A 646 19.027 7.705 5.201 1.00 0.00 H new ATOM 2164 N TYR A 647 18.525 5.462 3.521 1.00 0.00 N ATOM 2165 CA TYR A 647 18.858 4.279 2.740 1.00 0.00 C ATOM 2166 C TYR A 647 18.627 4.553 1.263 1.00 0.00 C ATOM 2167 O TYR A 647 19.470 4.177 0.453 1.00 0.00 O ATOM 2168 CB TYR A 647 18.035 3.067 3.175 1.00 0.00 C ATOM 2169 CG TYR A 647 18.146 2.704 4.639 1.00 0.00 C ATOM 2170 CD1 TYR A 647 19.403 2.599 5.269 1.00 0.00 C ATOM 2171 CD2 TYR A 647 16.975 2.425 5.360 1.00 0.00 C ATOM 2172 CE1 TYR A 647 19.487 2.215 6.618 1.00 0.00 C ATOM 2173 CE2 TYR A 647 17.057 2.044 6.705 1.00 0.00 C ATOM 2174 CZ TYR A 647 18.308 1.923 7.341 1.00 0.00 C ATOM 2175 OH TYR A 647 18.354 1.488 8.628 1.00 0.00 O ATOM 0 H TYR A 647 17.755 5.334 4.177 1.00 0.00 H new ATOM 0 HA TYR A 647 19.910 4.051 2.913 1.00 0.00 H new ATOM 0 HB2 TYR A 647 16.987 3.257 2.943 1.00 0.00 H new ATOM 0 HB3 TYR A 647 18.342 2.207 2.580 1.00 0.00 H new ATOM 0 HD1 TYR A 647 20.304 2.814 4.713 1.00 0.00 H new ATOM 0 HD2 TYR A 647 16.012 2.504 4.878 1.00 0.00 H new ATOM 0 HE1 TYR A 647 20.450 2.143 7.101 1.00 0.00 H new ATOM 0 HE2 TYR A 647 16.153 1.841 7.260 1.00 0.00 H new ATOM 0 HH TYR A 647 17.442 1.342 8.957 1.00 0.00 H new ATOM 2185 N LEU A 648 17.525 5.226 0.911 1.00 0.00 N ATOM 2186 CA LEU A 648 17.184 5.488 -0.490 1.00 0.00 C ATOM 2187 C LEU A 648 18.194 6.422 -1.142 1.00 0.00 C ATOM 2188 O LEU A 648 18.348 6.438 -2.357 1.00 0.00 O ATOM 2189 CB LEU A 648 15.779 6.091 -0.656 1.00 0.00 C ATOM 2190 CG LEU A 648 14.587 5.228 -0.199 1.00 0.00 C ATOM 2191 CD1 LEU A 648 13.365 5.545 -1.060 1.00 0.00 C ATOM 2192 CD2 LEU A 648 14.801 3.721 -0.309 1.00 0.00 C ATOM 0 H LEU A 648 16.853 5.600 1.581 1.00 0.00 H new ATOM 0 HA LEU A 648 17.205 4.516 -0.983 1.00 0.00 H new ATOM 0 HB2 LEU A 648 15.747 7.031 -0.105 1.00 0.00 H new ATOM 0 HB3 LEU A 648 15.637 6.334 -1.709 1.00 0.00 H new ATOM 0 HG LEU A 648 14.458 5.477 0.854 1.00 0.00 H new ATOM 0 HD11 LEU A 648 12.523 4.934 -0.736 1.00 0.00 H new ATOM 0 HD12 LEU A 648 13.110 6.599 -0.955 1.00 0.00 H new ATOM 0 HD13 LEU A 648 13.590 5.328 -2.104 1.00 0.00 H new ATOM 0 HD21 LEU A 648 13.907 3.201 0.036 1.00 0.00 H new ATOM 0 HD22 LEU A 648 14.997 3.456 -1.348 1.00 0.00 H new ATOM 0 HD23 LEU A 648 15.652 3.428 0.307 1.00 0.00 H new ATOM 2204 N THR A 649 18.873 7.228 -0.342 1.00 0.00 N ATOM 2205 CA THR A 649 19.908 8.120 -0.813 1.00 0.00 C ATOM 2206 C THR A 649 21.251 7.376 -0.886 1.00 0.00 C ATOM 2207 O THR A 649 22.041 7.620 -1.795 1.00 0.00 O ATOM 2208 CB THR A 649 19.914 9.325 0.135 1.00 0.00 C ATOM 2209 OG1 THR A 649 18.613 9.891 0.159 1.00 0.00 O ATOM 2210 CG2 THR A 649 20.887 10.414 -0.295 1.00 0.00 C ATOM 0 H THR A 649 18.715 7.278 0.664 1.00 0.00 H new ATOM 0 HA THR A 649 19.725 8.476 -1.827 1.00 0.00 H new ATOM 0 HB THR A 649 20.226 8.961 1.114 1.00 0.00 H new ATOM 0 HG1 THR A 649 18.034 9.355 0.739 1.00 0.00 H new ATOM 0 HG21 THR A 649 20.846 11.240 0.415 1.00 0.00 H new ATOM 0 HG22 THR A 649 21.898 10.008 -0.322 1.00 0.00 H new ATOM 0 HG23 THR A 649 20.615 10.774 -1.287 1.00 0.00 H new ATOM 2218 N SER A 650 21.517 6.443 0.031 1.00 0.00 N ATOM 2219 CA SER A 650 22.857 5.918 0.282 1.00 0.00 C ATOM 2220 C SER A 650 23.130 4.586 -0.433 1.00 0.00 C ATOM 2221 O SER A 650 24.273 4.130 -0.434 1.00 0.00 O ATOM 2222 CB SER A 650 23.020 5.821 1.805 1.00 0.00 C ATOM 2223 OG SER A 650 24.349 5.637 2.249 1.00 0.00 O ATOM 0 H SER A 650 20.799 6.028 0.625 1.00 0.00 H new ATOM 0 HA SER A 650 23.604 6.592 -0.137 1.00 0.00 H new ATOM 0 HB2 SER A 650 22.623 6.730 2.257 1.00 0.00 H new ATOM 0 HB3 SER A 650 22.412 4.993 2.169 1.00 0.00 H new ATOM 0 HG SER A 650 24.841 5.099 1.594 1.00 0.00 H new ATOM 2229 N SER A 651 22.134 3.942 -1.037 1.00 0.00 N ATOM 2230 CA SER A 651 22.260 2.657 -1.709 1.00 0.00 C ATOM 2231 C SER A 651 21.316 2.759 -2.892 1.00 0.00 C ATOM 2232 O SER A 651 21.763 2.759 -4.058 1.00 0.00 O ATOM 2233 CB SER A 651 21.912 1.563 -0.681 1.00 0.00 C ATOM 2234 OG SER A 651 22.171 0.240 -1.110 1.00 0.00 O ATOM 0 H SER A 651 21.186 4.316 -1.072 1.00 0.00 H new ATOM 0 HA SER A 651 23.253 2.402 -2.080 1.00 0.00 H new ATOM 0 HB2 SER A 651 22.476 1.750 0.233 1.00 0.00 H new ATOM 0 HB3 SER A 651 20.856 1.647 -0.426 1.00 0.00 H new ATOM 0 HG SER A 651 22.818 -0.179 -0.505 1.00 0.00 H new TER 2240 SER A 651